[4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate

C267H294O73 — CID 157235669

IUPAC[4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate
SMILESC=CC(=O)OCCCCOC(=O)c1ccc(-c2ccc(OC(=O)c3ccc(OC(=O)c4ccc(OCCCCOC(=O)C=C)c(OCCCCOC(=O)C=C)c4)cc3)cc2)cc1.C=CC(=O)OCCCCOC(=O)c1ccc(OC(=O)c2ccc(OC(=O)c3ccc(OCCCCOC(=O)C=C)cc3)cc2)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(OCCCCOC(=O)C=C)cc3)c(C)c2)cc1.CC1(COCCCCOC(=O)c2ccc(-c3ccc(OC(=O)c4ccc(OCCCCOCC5(C)COC5)cc4)cc3)cc2)COC1.CC1(COCCCCOc2ccc(C(=O)Oc3ccc(OC(=O)c4ccc(OCCCCOCC5(C)COC5)cc4)cc3)cc2)COC1.CCC1(COCCCCOc2ccc(C(=O)Oc3ccc(OC(=O)c4ccc(OCCCCOCC5(CC)COC5)cc4)cc3)cc2)COC1.O=C(OCCCCC1CO1)c1ccc(OC(=O)c2ccc(OC(=O)c3ccc(OCCCCC4CO4)cc3)cc2)cc1
InChIInChI=1S/C48H48O14.C40H50O10.C38H46O10.C38H46O9.C35H34O11.C35H36O10.C33H34O9/c1-4-43(49)57-29-9-7-27-55-41-26-21-38(33-42(41)56-28-8-10-30-58-44(50)5-2)48(54)62-40-24-19-37(20-25-40)47(53)61-39-22-17-35(18-23-39)34-13-15-36(16-14-34)46(52)60-32-12-11-31-59-45(51)6-3;1-3-39(27-45-28-39)25-43-21-5-7-23-47-33-13-9-31(10-14-33)37(41)49-35-17-19-36(20-18-35)50-38(42)32-11-15-34(16-12-32)48-24-8-6-22-44-26-40(4-2)29-46-30-40;1-37(25-43-26-37)23-41-19-3-5-21-45-31-11-7-29(8-12-31)35(39)47-33-15-17-34(18-16-33)48-36(40)30-9-13-32(14-10-30)46-22-6-4-20-42-24-38(2)27-44-28-38;1-37(25-43-26-37)23-41-19-3-5-21-45-33-15-13-32(14-16-33)36(40)47-34-17-11-30(12-18-34)29-7-9-31(10-8-29)35(39)46-22-6-4-20-42-24-38(2)27-44-28-38;1-3-31(36)42-22-6-5-21-41-28-15-9-26(10-16-28)34(39)46-30-19-13-27(14-20-30)35(40)45-29-17-11-25(12-18-29)33(38)44-24-8-7-23-43-32(37)4-2;1-4-32(36)42-22-8-6-20-40-28-14-10-26(11-15-28)34(38)44-30-18-19-31(25(3)24-30)45-35(39)27-12-16-29(17-13-27)41-21-7-9-23-43-33(37)5-2;34-31(38-20-4-2-6-30-22-40-30)23-9-15-27(16-10-23)41-33(36)25-11-17-28(18-12-25)42-32(35)24-7-13-26(14-8-24)37-19-3-1-5-29-21-39-29/h4-6,13-26,33H,1-3,7-12,27-32H2;9-20H,3-8,21-30H2,1-2H3;7-18H,3-6,19-28H2,1-2H3;7-18H,3-6,19-28H2,1-2H3;3-4,9-20H,1-2,5-8,21-24H2;4-5,10-19,24H,1-2,6-9,20-23H2,3H3;7-18,29-30H,1-6,19-22H2
InChIKeyAUPJPCKDOBDAIF-UHFFFAOYSA-N
MW4671.22 g/mol
LogP46.58
Rot. Bonds139

About [4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate

[4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate (PubChem CID 157235669) has the molecular formula C267H294O73 and a molecular weight of 4671.22 g/mol. Its IUPAC name is [4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate.

Molecular Properties

Compound Name[4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate
PubChem CID157235669
Molecular FormulaC267H294O73
Molecular Weight4671.22 g/mol
Exact Mass4667.93
IUPAC Name[4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate
SMILESC=CC(=O)OCCCCOC(=O)c1ccc(-c2ccc(OC(=O)c3ccc(OC(=O)c4ccc(OCCCCOC(=O)C=C)c(OCCCCOC(=O)C=C)c4)cc3)cc2)cc1.C=CC(=O)OCCCCOC(=O)c1ccc(OC(=O)c2ccc(OC(=O)c3ccc(OCCCCOC(=O)C=C)cc3)cc2)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(OCCCCOC(=O)C=C)cc3)c(C)c2)cc1.CC1(COCCCCOC(=O)c2ccc(-c3ccc(OC(=O)c4ccc(OCCCCOCC5(C)COC5)cc4)cc3)cc2)COC1.CC1(COCCCCOc2ccc(C(=O)Oc3ccc(OC(=O)c4ccc(OCCCCOCC5(C)COC5)cc4)cc3)cc2)COC1.CCC1(COCCCCOc2ccc(C(=O)Oc3ccc(OC(=O)c4ccc(OCCCCOCC5(CC)COC5)cc4)cc3)cc2)COC1.O=C(OCCCCC1CO1)c1ccc(OC(=O)c2ccc(OC(=O)c3ccc(OCCCCC4CO4)cc3)cc2)cc1
InChIInChI=1S/C48H48O14.C40H50O10.C38H46O10.C38H46O9.C35H34O11.C35H36O10.C33H34O9/c1-4-43(49)57-29-9-7-27-55-41-26-21-38(33-42(41)56-28-8-10-30-58-44(50)5-2)48(54)62-40-24-19-37(20-25-40)47(53)61-39-22-17-35(18-23-39)34-13-15-36(16-14-34)46(52)60-32-12-11-31-59-45(51)6-3;1-3-39(27-45-28-39)25-43-21-5-7-23-47-33-13-9-31(10-14-33)37(41)49-35-17-19-36(20-18-35)50-38(42)32-11-15-34(16-12-32)48-24-8-6-22-44-26-40(4-2)29-46-30-40;1-37(25-43-26-37)23-41-19-3-5-21-45-31-11-7-29(8-12-31)35(39)47-33-15-17-34(18-16-33)48-36(40)30-9-13-32(14-10-30)46-22-6-4-20-42-24-38(2)27-44-28-38;1-37(25-43-26-37)23-41-19-3-5-21-45-33-15-13-32(14-16-33)36(40)47-34-17-11-30(12-18-34)29-7-9-31(10-8-29)35(39)46-22-6-4-20-42-24-38(2)27-44-28-38;1-3-31(36)42-22-6-5-21-41-28-15-9-26(10-16-28)34(39)46-30-19-13-27(14-20-30)35(40)45-29-17-11-25(12-18-29)33(38)44-24-8-7-23-43-32(37)4-2;1-4-32(36)42-22-8-6-20-40-28-14-10-26(11-15-28)34(38)44-30-18-19-31(25(3)24-30)45-35(39)27-12-16-29(17-13-27)41-21-7-9-23-43-33(37)5-2;34-31(38-20-4-2-6-30-22-40-30)23-9-15-27(16-10-23)41-33(36)25-11-17-28(18-12-25)42-32(35)24-7-13-26(14-8-24)37-19-3-1-5-29-21-39-29/h4-6,13-26,33H,1-3,7-12,27-32H2;9-20H,3-8,21-30H2,1-2H3;7-18H,3-6,19-28H2,1-2H3;7-18H,3-6,19-28H2,1-2H3;3-4,9-20H,1-2,5-8,21-24H2;4-5,10-19,24H,1-2,6-9,20-23H2,3H3;7-18,29-30H,1-6,19-22H2
InChIKeyAUPJPCKDOBDAIF-UHFFFAOYSA-N
XLogP46.58
TPSA868.55 Ų
H-Bond Donors
H-Bond Acceptors73
Rotatable Bonds139
Heavy Atoms340
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004671.22
LogP ≤ 546.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1073

Analyze [4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate with MolForge

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Related Compounds

[3-methyl-4-[[4-(prop-2-enoyloxymethoxy)phenoxy]methoxy]phenyl] 4-(prop-2-enoyloxymethoxy)benzoate;[4-[[4-(4-prop-2-enoyloxybutoxy)phenoxy]methoxy]phenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate
CID 158486918
[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]phenyl] 2-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxybenzoate
CID 59762740
[4-[[4-(4-prop-2-enoyloxybutoxy)phenoxy]methoxy]phenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate
CID 59741740
[3-methyl-4-[4-[3-[(3-methyloxetan-3-yl)methoxy]propoxy]benzoyl]oxyphenyl] 4-[3-[(3-methyloxetan-3-yl)methoxy]propoxy]benzoate
CID 20607881
[4-[3-chloro-4-(4-prop-2-enoyloxybutoxycarbonyloxy)benzoyl]oxycyclohexyl] 3-chloro-4-(4-prop-2-enoyloxybutoxycarbonyloxy)benzoate;[4-[[4-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]phenoxy]methoxy]phenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;[3-methyl-4-[[4-(prop-2-enoyloxymethoxy)phenoxy]methoxy]phenyl] 4-(prop-2-enoyloxymethoxy)benzoate;[4-[[4-(4-prop-2-enoyloxybutoxy)phenoxy]methoxy]phenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[[4-[2-(2-prop-2-enoyloxyethoxy)ethoxy]phenoxy]methoxy]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[[4-[2-(2-prop-2-enoyloxyethoxy)ethoxy]phenoxy]methoxy]phenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate
CID 159364679
[4-(2-prop-2-enoyloxyethoxy)phenyl] 4-[4-[(1-ethylcyclobutyl)methoxy]butoxy]benzoate;[4-(2-prop-2-enoyloxyethoxy)phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate
CID 157156197
[2-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-phenylbenzoate
CID 118880201
[4-(4-prop-2-enoyloxybutoxy)phenyl] 3-methyl-4-[4-[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxybenzoyl]oxybenzoyl]oxybenzoate
CID 169077993
[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[3-methyl-4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyloxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxycarbonyloxy)benzoate;[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate
CID 162149365
[4-[4-[(3-ethyloxetan-3-yl)methoxy]benzoyl]oxy-3-(5-prop-2-enoyloxypentanoyloxy)phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate
CID 59702738
[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[3-methyl-4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate;[3-methyl-4-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxyphenyl] 4-(3-prop-2-enoyloxypropoxy)benzoate;[4-[4-(3-prop-2-enoxypropoxy)benzoyl]oxyphenyl] 4-(3-prop-2-enoxypropoxy)benzoate;2-[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl]ethyl 4-(6-prop-2-enoyloxyhexoxy)benzoate;2-[4-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxyphenyl]ethyl 4-(3-prop-2-enoyloxypropoxy)benzoate
CID 157356847
[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl]phenyl] 3-methoxy-4-(6-prop-2-enoyloxyhexoxy)benzoate
CID 59090125

Frequently Asked Questions

What is the IUPAC name of [4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate?
The IUPAC name of [4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate (CID 157235669) is [4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate.
What is the SMILES notation for [4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate?
The canonical SMILES for [4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate is C=CC(=O)OCCCCOC(=O)c1ccc(-c2ccc(OC(=O)c3ccc(OC(=O)c4ccc(OCCCCOC(=O)C=C)c(OCCCCOC(=O)C=C)c4)cc3)cc2)cc1.C=CC(=O)OCCCCOC(=O)c1ccc(OC(=O)c2ccc(OC(=O)c3ccc(OCCCCOC(=O)C=C)cc3)cc2)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(OCCCCOC(=O)C=C)cc3)c(C)c2)cc1.CC1(COCCCCOC(=O)c2ccc(-c3ccc(OC(=O)c4ccc(OCCCCOCC5(C)COC5)cc4)cc3)cc2)COC1.CC1(COCCCCOc2ccc(C(=O)Oc3ccc(OC(=O)c4ccc(OCCCCOCC5(C)COC5)cc4)cc3)cc2)COC1.CCC1(COCCCCOc2ccc(C(=O)Oc3ccc(OC(=O)c4ccc(OCCCCOCC5(CC)COC5)cc4)cc3)cc2)COC1.O=C(OCCCCC1CO1)c1ccc(OC(=O)c2ccc(OC(=O)c3ccc(OCCCCC4CO4)cc3)cc2)cc1.
What is the InChIKey of [4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate?
The InChIKey is AUPJPCKDOBDAIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H48O14.C40H50O10.C38H46O10.C38H46O9.C35H34O11.C35H36O10.C33H34O9/c1-4-43(49)57-29-9-7-27-55-41-26-21-38(33-42(41)56-28-8-10-30-58-44(50)5-2)48(54)62-40-24-19-37(20-25-40)47(53)61-39-22-17-35(18-23-39)34-13-15-36(16-14-34)46(52)60-32-12-11-31-59-45(51)6-3;1-3-39(27-45-28-39)25-43-21-5-7-23-47-33-13-9-31(10-14-33)37(41)49-35-17-19-36(20-18-35)50-38(42)32-11-15-34(16-12-32)48-24-8-6-22-44-26-40(4-2)29-46-30-40;1-37(25-43-26-37)23-41-19-3-5-21-45-31-11-7-29(8-12-31)35(39)47-33-15-17-34(18-16-33)48-36(40)30-9-13-32(14-10-30)46-22-6-4-20-42-24-38(2)27-44-28-38;1-37(25-43-26-37)23-41-19-3-5-21-45-33-15-13-32(14-16-33)36(40)47-34-17-11-30(12-18-34)29-7-9-31(10-8-29)35(39)46-22-6-4-20-42-24-38(2)27-44-28-38;1-3-31(36)42-22-6-5-21-41-28-15-9-26(10-16-28)34(39)46-30-19-13-27(14-20-30)35(40)45-29-17-11-25(12-18-29)33(38)44-24-8-7-23-43-32(37)4-2;1-4-32(36)42-22-8-6-20-40-28-14-10-26(11-15-28)34(38)44-30-18-19-31(25(3)24-30)45-35(39)27-12-16-29(17-13-27)41-21-7-9-23-43-33(37)5-2;34-31(38-20-4-2-6-30-22-40-30)23-9-15-27(16-10-23)41-33(36)25-11-17-28(18-12-25)42-32(35)24-7-13-26(14-8-24)37-19-3-1-5-29-21-39-29/h4-6,13-26,33H,1-3,7-12,27-32H2;9-20H,3-8,21-30H2,1-2H3;7-18H,3-6,19-28H2,1-2H3;7-18H,3-6,19-28H2,1-2H3;3-4,9-20H,1-2,5-8,21-24H2;4-5,10-19,24H,1-2,6-9,20-23H2,3H3;7-18,29-30H,1-6,19-22H2.
What are the key properties of [4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate?
[4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate has a molecular weight of 4671.22 g/mol, XLogP of 46.58, 139 rotatable bonds, 0 hydrogen bond donors, and 73 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;4-[(3-methyloxetan-3-yl)methoxy]butyl 4-[4-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxyphenyl]benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(oxiran-2-yl)butoxycarbonyl]phenoxy]carbonylphenyl] 4-[4-(oxiran-2-yl)butoxy]benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-[4-(4-prop-2-enoyloxybutoxycarbonyl)phenyl]phenoxy]carbonylphenyl] 3,4-bis(4-prop-2-enoyloxybutoxy)benzoate is sourced from PubChem (CID 157235669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).