[4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate

C301H300F10O85S7 — CID 159897546

IUPAC[4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate
SMILESC=C(C)C(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCCCOC(=O)C(=C)C)cc4)cc3)cc2)cc1.C=C(C)C(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCCCOC(=O)C(=C)C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCCCCCCCOC.C=CC(=O)OCCCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(O)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCCCOC(=O)C=C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCOC(=O)C=C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCOC(=O)C=C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCOc1ccc(CCC(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)CCc4ccc(OCCOC(=O)C=C)cc4)cc3)cc2)cc1
InChIInChI=1S/C46H48F2O12S.C46H50O12S.C44H44F2O12S.C40H36F2O12S.C40H38O12S.C37H34F2O10S.C36H28F2O12S.C12H22O3/c1-31(2)43(49)57-27-11-7-5-9-25-55-35-17-23-39(41(47)29-35)45(51)59-33-13-19-37(20-14-33)61(53,54)38-21-15-34(16-22-38)60-46(52)40-24-18-36(30-42(40)48)56-26-10-6-8-12-28-58-44(50)32(3)4;1-33(2)43(47)55-31-11-7-5-9-29-53-37-17-13-35(14-18-37)45(49)57-39-21-25-41(26-22-39)59(51,52)42-27-23-40(24-28-42)58-46(50)36-15-19-38(20-16-36)54-30-10-6-8-12-32-56-44(48)34(3)4;1-3-41(47)55-27-11-7-5-9-25-53-33-17-23-37(39(45)29-33)43(49)57-31-13-19-35(20-14-31)59(51,52)36-21-15-32(16-22-36)58-44(50)38-24-18-34(30-40(38)46)54-26-10-6-8-12-28-56-42(48)4-2;1-3-37(43)51-23-7-5-21-49-29-13-19-33(35(41)25-29)39(45)53-27-9-15-31(16-10-27)55(47,48)32-17-11-28(12-18-32)54-40(46)34-20-14-30(26-36(34)42)50-22-6-8-24-52-38(44)4-2;1-3-37(41)49-27-25-47-31-11-5-29(6-12-31)9-23-39(43)51-33-15-19-35(20-16-33)53(45,46)36-21-17-34(18-22-36)52-40(44)24-10-30-7-13-32(14-8-30)48-26-28-50-38(42)4-2;1-2-35(41)47-22-8-6-4-3-5-7-21-46-28-14-20-32(34(39)24-28)37(43)49-27-12-17-30(18-13-27)50(44,45)29-15-10-26(11-16-29)48-36(42)31-19-9-25(40)23-33(31)38;1-3-33(39)47-19-17-45-25-9-15-29(31(37)21-25)35(41)49-23-5-11-27(12-6-23)51(43,44)28-13-7-24(8-14-28)50-36(42)30-16-10-26(22-32(30)38)46-18-20-48-34(40)4-2;1-3-12(13)15-11-9-7-5-4-6-8-10-14-2/h13-24,29-30H,1,3,5-12,25-28H2,2,4H3;13-28H,1,3,5-12,29-32H2,2,4H3;3-4,13-24,29-30H,1-2,5-12,25-28H2;3-4,9-20,25-26H,1-2,5-8,21-24H2;3-8,11-22H,1-2,9-10,23-28H2;2,9-20,23-24,40H,1,3-8,21-22H2;3-16,21-22H,1-2,17-20H2;3H,1,4-11H2,2H3
InChIKeyNVNPMMXJHSUFCM-UHFFFAOYSA-N
MW5692.08 g/mol
LogP55.37
Rot. Bonds155

About [4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate

[4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate (PubChem CID 159897546) has the molecular formula C301H300F10O85S7 and a molecular weight of 5692.08 g/mol. Its IUPAC name is [4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate.

Molecular Properties

Compound Name[4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate
PubChem CID159897546
Molecular FormulaC301H300F10O85S7
Molecular Weight5692.08 g/mol
Exact Mass5687.70
IUPAC Name[4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate
SMILESC=C(C)C(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCCCOC(=O)C(=C)C)cc4)cc3)cc2)cc1.C=C(C)C(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCCCOC(=O)C(=C)C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCCCCCCCOC.C=CC(=O)OCCCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(O)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCCCOC(=O)C=C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCOC(=O)C=C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCOC(=O)C=C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCOc1ccc(CCC(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)CCc4ccc(OCCOC(=O)C=C)cc4)cc3)cc2)cc1
InChIInChI=1S/C46H48F2O12S.C46H50O12S.C44H44F2O12S.C40H36F2O12S.C40H38O12S.C37H34F2O10S.C36H28F2O12S.C12H22O3/c1-31(2)43(49)57-27-11-7-5-9-25-55-35-17-23-39(41(47)29-35)45(51)59-33-13-19-37(20-14-33)61(53,54)38-21-15-34(16-22-38)60-46(52)40-24-18-36(30-42(40)48)56-26-10-6-8-12-28-58-44(50)32(3)4;1-33(2)43(47)55-31-11-7-5-9-29-53-37-17-13-35(14-18-37)45(49)57-39-21-25-41(26-22-39)59(51,52)42-27-23-40(24-28-42)58-46(50)36-15-19-38(20-16-36)54-30-10-6-8-12-32-56-44(48)34(3)4;1-3-41(47)55-27-11-7-5-9-25-53-33-17-23-37(39(45)29-33)43(49)57-31-13-19-35(20-14-31)59(51,52)36-21-15-32(16-22-36)58-44(50)38-24-18-34(30-40(38)46)54-26-10-6-8-12-28-56-42(48)4-2;1-3-37(43)51-23-7-5-21-49-29-13-19-33(35(41)25-29)39(45)53-27-9-15-31(16-10-27)55(47,48)32-17-11-28(12-18-32)54-40(46)34-20-14-30(26-36(34)42)50-22-6-8-24-52-38(44)4-2;1-3-37(41)49-27-25-47-31-11-5-29(6-12-31)9-23-39(43)51-33-15-19-35(20-16-33)53(45,46)36-21-17-34(18-22-36)52-40(44)24-10-30-7-13-32(14-8-30)48-26-28-50-38(42)4-2;1-2-35(41)47-22-8-6-4-3-5-7-21-46-28-14-20-32(34(39)24-28)37(43)49-27-12-17-30(18-13-27)50(44,45)29-15-10-26(11-16-29)48-36(42)31-19-9-25(40)23-33(31)38;1-3-33(39)47-19-17-45-25-9-15-29(31(37)21-25)35(41)49-23-5-11-27(12-6-23)51(43,44)28-13-7-24(8-14-28)50-36(42)30-16-10-26(22-32(30)38)46-18-20-48-34(40)4-2;1-3-12(13)15-11-9-7-5-4-6-8-10-14-2/h13-24,29-30H,1,3,5-12,25-28H2,2,4H3;13-28H,1,3,5-12,29-32H2,2,4H3;3-4,13-24,29-30H,1-2,5-12,25-28H2;3-4,9-20,25-26H,1-2,5-8,21-24H2;3-8,11-22H,1-2,9-10,23-28H2;2,9-20,23-24,40H,1,3-8,21-22H2;3-16,21-22H,1-2,17-20H2;3H,1,4-11H2,2H3
InChIKeyNVNPMMXJHSUFCM-UHFFFAOYSA-N
XLogP55.37
TPSA1124.83 Ų
H-Bond Donors1
H-Bond Acceptors85
Rotatable Bonds155
Heavy Atoms403
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005692.08
LogP ≤ 555.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1085

Analyze [4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate with MolForge

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Related Compounds

[4-[4-[3-[4-(6-prop-2-enoyloxyhexoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] butanoate
CID 59747450
[3-fluoro-4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-[3-(2-methylprop-2-enoyloxy)propoxy]benzoate
CID 161330088
[4-[4-[2-(2-methylprop-2-enoyloxy)ethoxy]phenyl]phenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate
CID 154601614
[4-[3-(4-prop-2-enoyloxyphenyl)propanoyloxy]phenyl] 4-(3-prop-2-enoyloxypropoxy)benzoate
CID 170841969
4-O-[9,9-dimethyl-7-[4-(prop-2-enoyloxymethoxycarbonyl)benzoyl]oxyfluoren-2-yl] 1-O-(prop-2-enoyloxymethyl) benzene-1,4-dicarboxylate;[9,9-dimethyl-7-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyfluoren-2-yl] 4-(prop-2-enoyloxymethoxycarbonyloxy)benzoate;[9,9-dimethyl-7-[3-[4-(prop-2-enoyloxymethoxycarbonyloxy)phenyl]propanoyloxy]fluoren-2-yl] 3-[4-(prop-2-enoyloxymethoxycarbonyloxy)phenyl]propanoate;[9,9-dimethyl-7-[3-[4-(prop-2-enoyloxymethoxy)phenyl]propanoyloxy]fluoren-2-yl] 3-[4-(prop-2-enoyloxymethoxy)phenyl]propanoate;[7-[2-fluoro-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxy-9,9-dimethylfluoren-2-yl] 2-fluoro-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[7-[2-fluoro-4-(prop-2-enoyloxymethoxy)benzoyl]oxy-9,9-dimethylfluoren-2-yl] 2-fluoro-4-(prop-2-enoyloxymethoxy)benzoate
CID 158781796
methyl 2,5-bis[3-[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]propanoyloxy]benzoate
CID 134472267
[4-[2-[4-(6-prop-2-enoyloxyhexoxy)phenyl]ethyl]phenyl] 4-hydroxybenzoate
CID 90048613
[3-fluoro-4-[4-[12-(2-methylprop-2-enoyloxy)dodecoxy]benzoyl]oxyphenyl] 4-[12-(2-methylprop-2-enoyloxy)dodecoxy]benzoate
CID 157155566
[3-fluoro-4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl] 4-[3-(2-methylprop-2-enoyloxy)propoxy]benzoate
CID 161330090
[4-[1,1,1,3,3,3-hexafluoro-2-[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate
CID 160688082
[4-[6-(2-methylprop-2-enoyloxy)hexanoyloxy]phenyl] 4-butoxybenzoate
CID 101260763
[3,5-difluoro-4-[4-[14-(2-methylprop-2-enoyloxy)tetradecoxy]benzoyl]oxyphenyl] 4-[14-(2-methylprop-2-enoyloxy)tetradecoxy]benzoate
CID 157350086

Frequently Asked Questions

What is the IUPAC name of [4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate?
The IUPAC name of [4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate (CID 159897546) is [4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate.
What is the SMILES notation for [4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate?
The canonical SMILES for [4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate is C=C(C)C(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCCCOC(=O)C(=C)C)cc4)cc3)cc2)cc1.C=C(C)C(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCCCOC(=O)C(=C)C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCCCCCCCOC.C=CC(=O)OCCCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(O)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCCCOC(=O)C=C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCCCOC(=O)C=C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCCOC(=O)C=C)cc4F)cc3)cc2)c(F)c1.C=CC(=O)OCCOc1ccc(CCC(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)CCc4ccc(OCCOC(=O)C=C)cc4)cc3)cc2)cc1.
What is the InChIKey of [4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate?
The InChIKey is NVNPMMXJHSUFCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H48F2O12S.C46H50O12S.C44H44F2O12S.C40H36F2O12S.C40H38O12S.C37H34F2O10S.C36H28F2O12S.C12H22O3/c1-31(2)43(49)57-27-11-7-5-9-25-55-35-17-23-39(41(47)29-35)45(51)59-33-13-19-37(20-14-33)61(53,54)38-21-15-34(16-22-38)60-46(52)40-24-18-36(30-42(40)48)56-26-10-6-8-12-28-58-44(50)32(3)4;1-33(2)43(47)55-31-11-7-5-9-29-53-37-17-13-35(14-18-37)45(49)57-39-21-25-41(26-22-39)59(51,52)42-27-23-40(24-28-42)58-46(50)36-15-19-38(20-16-36)54-30-10-6-8-12-32-56-44(48)34(3)4;1-3-41(47)55-27-11-7-5-9-25-53-33-17-23-37(39(45)29-33)43(49)57-31-13-19-35(20-14-31)59(51,52)36-21-15-32(16-22-36)58-44(50)38-24-18-34(30-40(38)46)54-26-10-6-8-12-28-56-42(48)4-2;1-3-37(43)51-23-7-5-21-49-29-13-19-33(35(41)25-29)39(45)53-27-9-15-31(16-10-27)55(47,48)32-17-11-28(12-18-32)54-40(46)34-20-14-30(26-36(34)42)50-22-6-8-24-52-38(44)4-2;1-3-37(41)49-27-25-47-31-11-5-29(6-12-31)9-23-39(43)51-33-15-19-35(20-16-33)53(45,46)36-21-17-34(18-22-36)52-40(44)24-10-30-7-13-32(14-8-30)48-26-28-50-38(42)4-2;1-2-35(41)47-22-8-6-4-3-5-7-21-46-28-14-20-32(34(39)24-28)37(43)49-27-12-17-30(18-13-27)50(44,45)29-15-10-26(11-16-29)48-36(42)31-19-9-25(40)23-33(31)38;1-3-33(39)47-19-17-45-25-9-15-29(31(37)21-25)35(41)49-23-5-11-27(12-6-23)51(43,44)28-13-7-24(8-14-28)50-36(42)30-16-10-26(22-32(30)38)46-18-20-48-34(40)4-2;1-3-12(13)15-11-9-7-5-4-6-8-10-14-2/h13-24,29-30H,1,3,5-12,25-28H2,2,4H3;13-28H,1,3,5-12,29-32H2,2,4H3;3-4,13-24,29-30H,1-2,5-12,25-28H2;3-4,9-20,25-26H,1-2,5-8,21-24H2;3-8,11-22H,1-2,9-10,23-28H2;2,9-20,23-24,40H,1,3-8,21-22H2;3-16,21-22H,1-2,17-20H2;3H,1,4-11H2,2H3.
What are the key properties of [4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate?
[4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate has a molecular weight of 5692.08 g/mol, XLogP of 55.37, 155 rotatable bonds, 1 hydrogen bond donors, and 85 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-[2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(2-prop-2-enoyloxyethoxy)benzoate;[4-[4-[2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-[2-fluoro-4-(8-prop-2-enoyloxyoctoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-fluoro-4-hydroxybenzoate;8-methoxyoctyl prop-2-enoate;[4-[4-[4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoyl]oxyphenyl]sulfonylphenyl] 4-[6-(2-methylprop-2-enoyloxy)hexoxy]benzoate;[4-[4-[3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenyl] 3-[4-(2-prop-2-enoyloxyethoxy)phenyl]propanoate is sourced from PubChem (CID 159897546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).