2,3-bis[[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]carbonyloxy]butanedioate

Systemtic Name: 2,3-bis[[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]carbonyloxy]butanedioate Openeye Name: 2,3-bis[[4-[(E)-3-(4-pentylcyclohexyl)allyloxy]benzoyl]oxy]butanedioate CAS Name: 2,3-bis[oxo-[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]methoxy]butanedioate IUPAC Name: 2,3-bis[[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]benzoyl]oxy]butanedioate Traditional Name: 2,3-bis[[4-[(E)-3-(4-amylcyclohexyl)allyloxy]benzoyl]oxy]succinate Formula: C46H60O10-2 MolecularWeight: 772.9626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C=CCOC2=CC=C(C=C2)C(=O)OC(C(C(=O)[O-])OC(=O)C3=CC=C(C=C3)OCC=CC4CCC(CC4)CCCCC)C(=O)[O-]

Isomeric SMILES

CCCCCC1CCC(CC1)/C=C/COC2=CC=C(C=C2)C(=O)OC(C(=O)[O-])C(OC(=O)C3=CC=C(C=C3)OC/C=C/C4CCC(CC4)CCCCC)C(=O)[O-]

InChI

InChI=1S/C46H62O10/c1-3-5-7-11-33-15-19-35(20-16-33)13-9-31-53-39-27-23-37(24-28-39)45(51)55-41(43(47)48)42(44(49)50)56-46(52)38-25-29-40(30-26-38)54-32-10-14-36-21-17-34(18-22-36)12-8-6-4-2/h9-10,13-14,23-30,33-36,41-42H,3-8,11-12,15-22,31-32H2,1-2H3,(H,47,48)(H,49,50)/p-2/b13-9+,14-10+