bis[[4-(4-pentylcyclohexyl)phenyl]methyl] (3R,4R)-3,4-dimethoxyhexanedioate

Systemtic Name: bis[[4-(4-pentylcyclohexyl)phenyl]methyl] (3R,4R)-3,4-dimethoxyhexanedioate Openeye Name: bis[[4-(4-pentylcyclohexyl)phenyl]methyl] (3R,4R)-3,4-dimethoxyhexanedioate CAS Name: (3R,4R)-3,4-dimethoxyhexanedioic acid bis[[4-(4-pentylcyclohexyl)phenyl]methyl] ester IUPAC Name: bis[[4-(4-pentylcyclohexyl)phenyl]methyl] (3R,4R)-3,4-dimethoxyhexanedioate Traditional Name: (3R,4R)-3,4-dimethoxyadipic acid bis[4-(4-amylcyclohexyl)benzyl] ester Formula: C44H66O6 MolecularWeight: 690.99124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)COC(=O)CC(C(CC(=O)OCC3=CC=C(C=C3)C4CCC(CC4)CCCCC)OC)OC

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)COC(=O)C[C@H]([C@@H](CC(=O)OCC3=CC=C(C=C3)C4CCC(CC4)CCCCC)OC)OC

InChI

InChI=1S/C44H66O6/c1-5-7-9-11-33-13-21-37(22-14-33)39-25-17-35(18-26-39)31-49-43(45)29-41(47-3)42(48-4)30-44(46)50-32-36-19-27-40(28-20-36)38-23-15-34(16-24-38)12-10-8-6-2/h17-20,25-28,33-34,37-38,41-42H,5-16,21-24,29-32H2,1-4H3/t33?,34?,37?,38?,41-,42-/m1/s1