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

C238H196F4O70 — CID 158781796

IUPAC4-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
SMILESC=C(C)C(=O)OCOc1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(OCOC(=O)C(=C)C)cc4F)ccc2-3)c(F)c1.C=CC(=O)OCOC(=O)Oc1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(OC(=O)OCOC(=O)C=C)cc4)ccc2-3)cc1.C=CC(=O)OCOC(=O)Oc1ccc(CCC(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)CCc4ccc(OC(=O)OCOC(=O)C=C)cc4)ccc2-3)cc1.C=CC(=O)OCOC(=O)c1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(C(=O)OCOC(=O)C=C)cc4)ccc2-3)cc1.C=CC(=O)OCOc1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(OCOC(=O)C=C)cc4F)ccc2-3)c(F)c1.C=CC(=O)OCOc1ccc(CCC(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)CCc4ccc(OCOC(=O)C=C)cc4)ccc2-3)cc1
InChIInChI=1S/C43H38O14.C41H38O10.C39H32F2O10.C39H30O14.C39H30O12.C37H28F2O10/c1-5-37(44)50-25-52-41(48)56-29-13-7-27(8-14-29)11-21-39(46)54-31-17-19-33-34-20-18-32(24-36(34)43(3,4)35(33)23-31)55-40(47)22-12-28-9-15-30(16-10-28)57-42(49)53-26-51-38(45)6-2;1-5-37(42)48-25-46-29-13-7-27(8-14-29)11-21-39(44)50-31-17-19-33-34-20-18-32(24-36(34)41(3,4)35(33)23-31)51-40(45)22-12-28-9-15-30(16-10-28)47-26-49-38(43)6-2;1-21(2)35(42)48-19-46-23-7-13-29(33(40)17-23)37(44)50-25-9-11-27-28-12-10-26(16-32(28)39(5,6)31(27)15-25)51-38(45)30-14-8-24(18-34(30)41)47-20-49-36(43)22(3)4;1-5-33(40)46-21-48-37(44)52-25-11-7-23(8-12-25)35(42)50-27-15-17-29-30-18-16-28(20-32(30)39(3,4)31(29)19-27)51-36(43)24-9-13-26(14-10-24)53-38(45)49-22-47-34(41)6-2;1-5-33(40)46-21-48-35(42)23-7-11-25(12-8-23)37(44)50-27-15-17-29-30-18-16-28(20-32(30)39(3,4)31(29)19-27)51-38(45)26-13-9-24(10-14-26)36(43)49-22-47-34(41)6-2;1-5-33(40)46-19-44-21-7-13-27(31(38)17-21)35(42)48-23-9-11-25-26-12-10-24(16-30(26)37(3,4)29(25)15-23)49-36(43)28-14-8-22(18-32(28)39)45-20-47-34(41)6-2/h5-10,13-20,23-24H,1-2,11-12,21-22,25-26H2,3-4H3;5-10,13-20,23-24H,1-2,11-12,21-22,25-26H2,3-4H3;7-18H,1,3,19-20H2,2,4-6H3;5-20H,1-2,21-22H2,3-4H3;5-20H,1-2,21-22H2,3-4H3;5-18H,1-2,19-20H2,3-4H3
InChIKeyIREFLGOSGBBXRF-UHFFFAOYSA-N
MW4252.11 g/mol
LogP42.09
Rot. Bonds80

About 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

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 (PubChem CID 158781796) has the molecular formula C238H196F4O70 and a molecular weight of 4252.11 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name4-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
PubChem CID158781796
Molecular FormulaC238H196F4O70
Molecular Weight4252.11 g/mol
Exact Mass4249.17
IUPAC Name4-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
SMILESC=C(C)C(=O)OCOc1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(OCOC(=O)C(=C)C)cc4F)ccc2-3)c(F)c1.C=CC(=O)OCOC(=O)Oc1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(OC(=O)OCOC(=O)C=C)cc4)ccc2-3)cc1.C=CC(=O)OCOC(=O)Oc1ccc(CCC(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)CCc4ccc(OC(=O)OCOC(=O)C=C)cc4)ccc2-3)cc1.C=CC(=O)OCOC(=O)c1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(C(=O)OCOC(=O)C=C)cc4)ccc2-3)cc1.C=CC(=O)OCOc1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(OCOC(=O)C=C)cc4F)ccc2-3)c(F)c1.C=CC(=O)OCOc1ccc(CCC(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)CCc4ccc(OCOC(=O)C=C)cc4)ccc2-3)cc1
InChIInChI=1S/C43H38O14.C41H38O10.C39H32F2O10.C39H30O14.C39H30O12.C37H28F2O10/c1-5-37(44)50-25-52-41(48)56-29-13-7-27(8-14-29)11-21-39(46)54-31-17-19-33-34-20-18-32(24-36(34)43(3,4)35(33)23-31)55-40(47)22-12-28-9-15-30(16-10-28)57-42(49)53-26-51-38(45)6-2;1-5-37(42)48-25-46-29-13-7-27(8-14-29)11-21-39(44)50-31-17-19-33-34-20-18-32(24-36(34)41(3,4)35(33)23-31)51-40(45)22-12-28-9-15-30(16-10-28)47-26-49-38(43)6-2;1-21(2)35(42)48-19-46-23-7-13-29(33(40)17-23)37(44)50-25-9-11-27-28-12-10-26(16-32(28)39(5,6)31(27)15-25)51-38(45)30-14-8-24(18-34(30)41)47-20-49-36(43)22(3)4;1-5-33(40)46-21-48-37(44)52-25-11-7-23(8-12-25)35(42)50-27-15-17-29-30-18-16-28(20-32(30)39(3,4)31(29)19-27)51-36(43)24-9-13-26(14-10-24)53-38(45)49-22-47-34(41)6-2;1-5-33(40)46-21-48-35(42)23-7-11-25(12-8-23)37(44)50-27-15-17-29-30-18-16-28(20-32(30)39(3,4)31(29)19-27)51-38(45)26-13-9-24(10-14-26)36(43)49-22-47-34(41)6-2;1-5-33(40)46-19-44-21-7-13-27(31(38)17-21)35(42)48-23-9-11-25-26-12-10-24(16-30(26)37(3,4)29(25)15-23)49-36(43)28-14-8-22(18-32(28)39)45-20-47-34(41)6-2/h5-10,13-20,23-24H,1-2,11-12,21-22,25-26H2,3-4H3;5-10,13-20,23-24H,1-2,11-12,21-22,25-26H2,3-4H3;7-18H,1,3,19-20H2,2,4-6H3;5-20H,1-2,21-22H2,3-4H3;5-20H,1-2,21-22H2,3-4H3;5-18H,1-2,19-20H2,3-4H3
InChIKeyIREFLGOSGBBXRF-UHFFFAOYSA-N
XLogP42.09
TPSA881.30 Ų
H-Bond Donors
H-Bond Acceptors70
Rotatable Bonds80
Heavy Atoms312
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004252.11
LogP ≤ 542.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1070

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is C=C(C)C(=O)OCOc1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(OCOC(=O)C(=C)C)cc4F)ccc2-3)c(F)c1.C=CC(=O)OCOC(=O)Oc1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(OC(=O)OCOC(=O)C=C)cc4)ccc2-3)cc1.C=CC(=O)OCOC(=O)Oc1ccc(CCC(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)CCc4ccc(OC(=O)OCOC(=O)C=C)cc4)ccc2-3)cc1.C=CC(=O)OCOC(=O)c1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(C(=O)OCOC(=O)C=C)cc4)ccc2-3)cc1.C=CC(=O)OCOc1ccc(C(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)c4ccc(OCOC(=O)C=C)cc4F)ccc2-3)c(F)c1.C=CC(=O)OCOc1ccc(CCC(=O)Oc2ccc3c(c2)C(C)(C)c2cc(OC(=O)CCc4ccc(OCOC(=O)C=C)cc4)ccc2-3)cc1.
What is the InChIKey of 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?
The InChIKey is IREFLGOSGBBXRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H38O14.C41H38O10.C39H32F2O10.C39H30O14.C39H30O12.C37H28F2O10/c1-5-37(44)50-25-52-41(48)56-29-13-7-27(8-14-29)11-21-39(46)54-31-17-19-33-34-20-18-32(24-36(34)43(3,4)35(33)23-31)55-40(47)22-12-28-9-15-30(16-10-28)57-42(49)53-26-51-38(45)6-2;1-5-37(42)48-25-46-29-13-7-27(8-14-29)11-21-39(44)50-31-17-19-33-34-20-18-32(24-36(34)41(3,4)35(33)23-31)51-40(45)22-12-28-9-15-30(16-10-28)47-26-49-38(43)6-2;1-21(2)35(42)48-19-46-23-7-13-29(33(40)17-23)37(44)50-25-9-11-27-28-12-10-26(16-32(28)39(5,6)31(27)15-25)51-38(45)30-14-8-24(18-34(30)41)47-20-49-36(43)22(3)4;1-5-33(40)46-21-48-37(44)52-25-11-7-23(8-12-25)35(42)50-27-15-17-29-30-18-16-28(20-32(30)39(3,4)31(29)19-27)51-36(43)24-9-13-26(14-10-24)53-38(45)49-22-47-34(41)6-2;1-5-33(40)46-21-48-35(42)23-7-11-25(12-8-23)37(44)50-27-15-17-29-30-18-16-28(20-32(30)39(3,4)31(29)19-27)51-38(45)26-13-9-24(10-14-26)36(43)49-22-47-34(41)6-2;1-5-33(40)46-19-44-21-7-13-27(31(38)17-21)35(42)48-23-9-11-25-26-12-10-24(16-30(26)37(3,4)29(25)15-23)49-36(43)28-14-8-22(18-32(28)39)45-20-47-34(41)6-2/h5-10,13-20,23-24H,1-2,11-12,21-22,25-26H2,3-4H3;5-10,13-20,23-24H,1-2,11-12,21-22,25-26H2,3-4H3;7-18H,1,3,19-20H2,2,4-6H3;5-20H,1-2,21-22H2,3-4H3;5-20H,1-2,21-22H2,3-4H3;5-18H,1-2,19-20H2,3-4H3.
What are the key properties of 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?
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 has a molecular weight of 4252.11 g/mol, XLogP of 42.09, 80 rotatable bonds, 0 hydrogen bond donors, and 70 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 158781796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).