dimethyl (3R,4R)-3,4-bis[[4-(4-pentylcyclohexyl)phenyl]carbonyloxy]hexanedioate

Systemtic Name: dimethyl (3R,4R)-3,4-bis[[4-(4-pentylcyclohexyl)phenyl]carbonyloxy]hexanedioate Openeye Name: dimethyl (3R,4R)-3,4-bis[[4-(4-pentylcyclohexyl)benzoyl]oxy]hexanedioate CAS Name: (3R,4R)-3,4-bis[oxo-[4-(4-pentylcyclohexyl)phenyl]methoxy]hexanedioic acid dimethyl ester IUPAC Name: dimethyl (3R,4R)-3,4-bis[[4-(4-pentylcyclohexyl)benzoyl]oxy]hexanedioate Traditional Name: (3R,4R)-3,4-bis[[4-(4-amylcyclohexyl)benzoyl]oxy]adipic acid dimethyl ester Formula: C44H62O8 MolecularWeight: 718.95828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC(CC(=O)OC)C(CC(=O)OC)OC(=O)C3=CC=C(C=C3)C4CCC(CC4)CCCCC

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)O[C@H](CC(=O)OC)[C@@H](CC(=O)OC)OC(=O)C3=CC=C(C=C3)C4CCC(CC4)CCCCC

InChI

InChI=1S/C44H62O8/c1-5-7-9-11-31-13-17-33(18-14-31)35-21-25-37(26-22-35)43(47)51-39(29-41(45)49-3)40(30-42(46)50-4)52-44(48)38-27-23-36(24-28-38)34-19-15-32(16-20-34)12-10-8-6-2/h21-28,31-34,39-40H,5-20,29-30H2,1-4H3/t31?,32?,33?,34?,39-,40-/m1/s1