[1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate

C335H253N3O63 — CID 158211855

IUPAC[1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate
SMILESC=CC(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc3ccccc3c2-c2c(OC(=O)c3ccc(C#N)cc3)ccc3ccccc23)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc3cc(C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)c5ccc6cc(OC(=O)c7ccc(OCCCCOC(=O)C=C)cc7)ccc6c5)ccc5ccccc45)ccc3c2)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc3ccccc3c2-c2c(OC(=O)c3ccc(C#N)cc3)ccc3ccccc23)cc1.C=CC(=O)OCCCCOc1ccc2cc(C(=O)Oc3ccc(C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)c5ccc(OC(=O)c6ccc7cc(OCCCCOC(=O)C=C)ccc7c6)cc5)ccc5ccccc45)cc3)ccc2c1.C=CC(=O)OCCCOc1ccc(C(=O)Oc2ccc3cc(C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)c5ccc6cc(OC(=O)c7ccc(OCCCOC(=O)C=C)cc7)ccc6c5)ccc5ccccc45)ccc3c2)cc1.C=CC(=O)OCCCOc1ccc(C(=O)Oc2ccc3ccccc3c2-c2c(OC(=O)c3ccc(C#N)cc3)ccc3ccccc23)cc1
InChIInChI=1S/2C70H54O14.C68H50O14.C44H35NO7.C42H31NO7.C41H29NO7/c1-3-63(71)79-39-11-9-37-77-57-33-25-49-41-53(19-17-51(49)43-57)69(75)81-55-29-21-47(22-30-55)67(73)83-61-35-27-45-13-5-7-15-59(45)65(61)66-60-16-8-6-14-46(60)28-36-62(66)84-68(74)48-23-31-56(32-24-48)82-70(76)54-20-18-52-44-58(34-26-50(52)42-54)78-38-10-12-40-80-64(72)4-2;1-3-63(71)79-39-11-9-37-77-55-29-21-47(22-30-55)67(73)81-57-33-25-49-41-53(19-17-51(49)43-57)69(75)83-61-35-27-45-13-5-7-15-59(45)65(61)66-60-16-8-6-14-46(60)28-36-62(66)84-70(76)54-20-18-52-44-58(34-26-50(52)42-54)82-68(74)48-23-31-56(32-24-48)78-38-10-12-40-80-64(72)4-2;1-3-61(69)77-37-9-35-75-53-27-19-45(20-28-53)65(71)79-55-31-23-47-39-51(17-15-49(47)41-55)67(73)81-59-33-25-43-11-5-7-13-57(43)63(59)64-58-14-8-6-12-44(58)26-34-60(64)82-68(74)52-18-16-50-42-56(32-24-48(50)40-52)80-66(72)46-21-29-54(30-22-46)76-36-10-38-78-62(70)4-2;1-2-40(46)50-28-10-4-3-9-27-49-35-23-19-34(20-24-35)44(48)52-39-26-22-32-12-6-8-14-37(32)42(39)41-36-13-7-5-11-31(36)21-25-38(41)51-43(47)33-17-15-30(29-45)16-18-33;1-2-38(44)48-26-8-7-25-47-33-21-17-32(18-22-33)42(46)50-37-24-20-30-10-4-6-12-35(30)40(37)39-34-11-5-3-9-29(34)19-23-36(39)49-41(45)31-15-13-28(27-43)14-16-31;1-2-37(43)47-25-7-24-46-32-20-16-31(17-21-32)41(45)49-36-23-19-29-9-4-6-11-34(29)39(36)38-33-10-5-3-8-28(33)18-22-35(38)48-40(44)30-14-12-27(26-42)13-15-30/h2*3-8,13-36,41-44H,1-2,9-12,37-40H2;3-8,11-34,39-42H,1-2,9-10,35-38H2;2,5-8,11-26H,1,3-4,9-10,27-28H2;2-6,9-24H,1,7-8,25-26H2;2-6,8-23H,1,7,24-25H2
InChIKeyGCEGHFZCUIOCCH-UHFFFAOYSA-N
MW5328.67 g/mol
LogP70.04
Rot. Bonds104

About [1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate

[1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate (PubChem CID 158211855) has the molecular formula C335H253N3O63 and a molecular weight of 5328.67 g/mol. Its IUPAC name is [1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate.

Molecular Properties

Compound Name[1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate
PubChem CID158211855
Molecular FormulaC335H253N3O63
Molecular Weight5328.67 g/mol
Exact Mass5324.67
IUPAC Name[1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate
SMILESC=CC(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc3ccccc3c2-c2c(OC(=O)c3ccc(C#N)cc3)ccc3ccccc23)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc3cc(C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)c5ccc6cc(OC(=O)c7ccc(OCCCCOC(=O)C=C)cc7)ccc6c5)ccc5ccccc45)ccc3c2)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc3ccccc3c2-c2c(OC(=O)c3ccc(C#N)cc3)ccc3ccccc23)cc1.C=CC(=O)OCCCCOc1ccc2cc(C(=O)Oc3ccc(C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)c5ccc(OC(=O)c6ccc7cc(OCCCCOC(=O)C=C)ccc7c6)cc5)ccc5ccccc45)cc3)ccc2c1.C=CC(=O)OCCCOc1ccc(C(=O)Oc2ccc3cc(C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)c5ccc6cc(OC(=O)c7ccc(OCCCOC(=O)C=C)cc7)ccc6c5)ccc5ccccc45)ccc3c2)cc1.C=CC(=O)OCCCOc1ccc(C(=O)Oc2ccc3ccccc3c2-c2c(OC(=O)c3ccc(C#N)cc3)ccc3ccccc23)cc1
InChIInChI=1S/2C70H54O14.C68H50O14.C44H35NO7.C42H31NO7.C41H29NO7/c1-3-63(71)79-39-11-9-37-77-57-33-25-49-41-53(19-17-51(49)43-57)69(75)81-55-29-21-47(22-30-55)67(73)83-61-35-27-45-13-5-7-15-59(45)65(61)66-60-16-8-6-14-46(60)28-36-62(66)84-68(74)48-23-31-56(32-24-48)82-70(76)54-20-18-52-44-58(34-26-50(52)42-54)78-38-10-12-40-80-64(72)4-2;1-3-63(71)79-39-11-9-37-77-55-29-21-47(22-30-55)67(73)81-57-33-25-49-41-53(19-17-51(49)43-57)69(75)83-61-35-27-45-13-5-7-15-59(45)65(61)66-60-16-8-6-14-46(60)28-36-62(66)84-70(76)54-20-18-52-44-58(34-26-50(52)42-54)82-68(74)48-23-31-56(32-24-48)78-38-10-12-40-80-64(72)4-2;1-3-61(69)77-37-9-35-75-53-27-19-45(20-28-53)65(71)79-55-31-23-47-39-51(17-15-49(47)41-55)67(73)81-59-33-25-43-11-5-7-13-57(43)63(59)64-58-14-8-6-12-44(58)26-34-60(64)82-68(74)52-18-16-50-42-56(32-24-48(50)40-52)80-66(72)46-21-29-54(30-22-46)76-36-10-38-78-62(70)4-2;1-2-40(46)50-28-10-4-3-9-27-49-35-23-19-34(20-24-35)44(48)52-39-26-22-32-12-6-8-14-37(32)42(39)41-36-13-7-5-11-31(36)21-25-38(41)51-43(47)33-17-15-30(29-45)16-18-33;1-2-38(44)48-26-8-7-25-47-33-21-17-32(18-22-33)42(46)50-37-24-20-30-10-4-6-12-35(30)40(37)39-34-11-5-3-9-29(34)19-23-36(39)49-41(45)31-15-13-28(27-43)14-16-31;1-2-37(43)47-25-7-24-46-32-20-16-31(17-21-32)41(45)49-36-23-19-29-9-4-6-11-34(29)39(36)38-33-10-5-3-8-28(33)18-22-35(38)48-40(44)30-14-12-27(26-42)13-15-30/h2*3-8,13-36,41-44H,1-2,9-12,37-40H2;3-8,11-34,39-42H,1-2,9-10,35-38H2;2,5-8,11-26H,1,3-4,9-10,27-28H2;2-6,9-24H,1,7-8,25-26H2;2-6,8-23H,1,7,24-25H2
InChIKeyGCEGHFZCUIOCCH-UHFFFAOYSA-N
XLogP70.04
TPSA864.54 Ų
H-Bond Donors
H-Bond Acceptors66
Rotatable Bonds104
Heavy Atoms401
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005328.67
LogP ≤ 570.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1066

Analyze [1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate with MolForge

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Related Compounds

[1-[3-[6-[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxybenzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxybenzoyl]oxynaphthalene-2-carboxylate
CID 118100011
[1-[3-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-(4-prop-2-enoyloxybutoxy)benzoate
CID 118100009
(4-cyanophenyl) 4-(3-prop-2-enoyloxypropoxy)benzoate
CID 59768911
[4-[4-cyano-2-[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxybenzoyl]oxyphenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate
CID 18979510
[3-hydroxy-4-[6-(6-prop-2-enoyloxyhexoxy)naphthalene-2-carbonyl]oxyphenyl] 6-(6-prop-2-enoyloxyhexoxy)naphthalene-2-carboxylate
CID 89003490
[4-(4-cyanophenyl)phenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate
CID 59748502
[4-(7-prop-2-enoyloxyheptoxycarbonyl)phenyl] 4-cyanobenzoate
CID 102401535
[4-(8-prop-2-enoyloxyoctoxycarbonyl)phenyl] 4-cyanobenzoate
CID 102401537
2-[6-[4-(4-cyanophenyl)phenoxy]hexoxy]-5-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxybenzoic acid
CID 22709074
8-[4-(4-cyanophenyl)phenoxy]octyl 2,5-bis[[4-[2-[4-(6-prop-2-enoyloxyhexoxy)phenyl]ethynyl]benzoyl]oxy]benzoate
CID 168916957
[4-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxyphenyl] 3,4-di(prop-2-enoyloxy)benzoate
CID 59181112
[3,4-bis[[4-(10-prop-2-enoyloxydecoxy)benzoyl]oxy]phenyl] 4-(10-prop-2-enoyloxydecoxy)benzoate
CID 23355747

Frequently Asked Questions

What is the IUPAC name of [1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate?
The IUPAC name of [1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate (CID 158211855) is [1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate.
What is the SMILES notation for [1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate?
The canonical SMILES for [1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate is C=CC(=O)OCCCCCCOc1ccc(C(=O)Oc2ccc3ccccc3c2-c2c(OC(=O)c3ccc(C#N)cc3)ccc3ccccc23)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc3cc(C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)c5ccc6cc(OC(=O)c7ccc(OCCCCOC(=O)C=C)cc7)ccc6c5)ccc5ccccc45)ccc3c2)cc1.C=CC(=O)OCCCCOc1ccc(C(=O)Oc2ccc3ccccc3c2-c2c(OC(=O)c3ccc(C#N)cc3)ccc3ccccc23)cc1.C=CC(=O)OCCCCOc1ccc2cc(C(=O)Oc3ccc(C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)c5ccc(OC(=O)c6ccc7cc(OCCCCOC(=O)C=C)ccc7c6)cc5)ccc5ccccc45)cc3)ccc2c1.C=CC(=O)OCCCOc1ccc(C(=O)Oc2ccc3cc(C(=O)Oc4ccc5ccccc5c4-c4c(OC(=O)c5ccc6cc(OC(=O)c7ccc(OCCCOC(=O)C=C)cc7)ccc6c5)ccc5ccccc45)ccc3c2)cc1.C=CC(=O)OCCCOc1ccc(C(=O)Oc2ccc3ccccc3c2-c2c(OC(=O)c3ccc(C#N)cc3)ccc3ccccc23)cc1.
What is the InChIKey of [1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate?
The InChIKey is GCEGHFZCUIOCCH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C70H54O14.C68H50O14.C44H35NO7.C42H31NO7.C41H29NO7/c1-3-63(71)79-39-11-9-37-77-57-33-25-49-41-53(19-17-51(49)43-57)69(75)81-55-29-21-47(22-30-55)67(73)83-61-35-27-45-13-5-7-15-59(45)65(61)66-60-16-8-6-14-46(60)28-36-62(66)84-68(74)48-23-31-56(32-24-48)82-70(76)54-20-18-52-44-58(34-26-50(52)42-54)78-38-10-12-40-80-64(72)4-2;1-3-63(71)79-39-11-9-37-77-55-29-21-47(22-30-55)67(73)81-57-33-25-49-41-53(19-17-51(49)43-57)69(75)83-61-35-27-45-13-5-7-15-59(45)65(61)66-60-16-8-6-14-46(60)28-36-62(66)84-70(76)54-20-18-52-44-58(34-26-50(52)42-54)82-68(74)48-23-31-56(32-24-48)78-38-10-12-40-80-64(72)4-2;1-3-61(69)77-37-9-35-75-53-27-19-45(20-28-53)65(71)79-55-31-23-47-39-51(17-15-49(47)41-55)67(73)81-59-33-25-43-11-5-7-13-57(43)63(59)64-58-14-8-6-12-44(58)26-34-60(64)82-68(74)52-18-16-50-42-56(32-24-48(50)40-52)80-66(72)46-21-29-54(30-22-46)76-36-10-38-78-62(70)4-2;1-2-40(46)50-28-10-4-3-9-27-49-35-23-19-34(20-24-35)44(48)52-39-26-22-32-12-6-8-14-37(32)42(39)41-36-13-7-5-11-31(36)21-25-38(41)51-43(47)33-17-15-30(29-45)16-18-33;1-2-38(44)48-26-8-7-25-47-33-21-17-32(18-22-33)42(46)50-37-24-20-30-10-4-6-12-35(30)40(37)39-34-11-5-3-9-29(34)19-23-36(39)49-41(45)31-15-13-28(27-43)14-16-31;1-2-37(43)47-25-7-24-46-32-20-16-31(17-21-32)41(45)49-36-23-19-29-9-4-6-11-34(29)39(36)38-33-10-5-3-8-28(33)18-22-35(38)48-40(44)30-14-12-27(26-42)13-15-30/h2*3-8,13-36,41-44H,1-2,9-12,37-40H2;3-8,11-34,39-42H,1-2,9-10,35-38H2;2,5-8,11-26H,1,3-4,9-10,27-28H2;2-6,9-24H,1,7-8,25-26H2;2-6,8-23H,1,7,24-25H2.
What are the key properties of [1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate?
[1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate has a molecular weight of 5328.67 g/mol, XLogP of 70.04, 104 rotatable bonds, 0 hydrogen bond donors, and 66 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-[6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[4-[1-[2-[4-[6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carbonyl]oxybenzoyl]oxynaphthalen-1-yl]naphthalen-2-yl]oxycarbonylphenyl] 6-(4-prop-2-enoyloxybutoxy)naphthalene-2-carboxylate;[1-[2-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate;[1-[2-[6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carbonyl]oxynaphthalen-1-yl]naphthalen-2-yl] 6-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalene-2-carboxylate;[1-[2-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxynaphthalen-1-yl]naphthalen-2-yl] 4-cyanobenzoate is sourced from PubChem (CID 158211855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).