(4-pentylcyclohexyl) 4-(4-heptylcyclohexen-1-yl)benzoate

Systemtic Name: (4-pentylcyclohexyl) 4-(4-heptylcyclohexen-1-yl)benzoate Openeye Name: (4-pentylcyclohexyl) 4-(4-heptylcyclohexen-1-yl)benzoate CAS Name: 4-(4-heptyl-1-cyclohexenyl)benzoic acid (4-pentylcyclohexyl) ester IUPAC Name: (4-pentylcyclohexyl) 4-(4-heptylcyclohexen-1-yl)benzoate Traditional Name: 4-(4-heptylcyclohexen-1-yl)benzoic acid (4-amylcyclohexyl) ester Formula: C31H48O2 MolecularWeight: 452.71162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)CCCCC

InChI

InChI=1S/C31H48O2/c1-3-5-7-8-10-12-25-13-17-27(18-14-25)28-19-21-29(22-20-28)31(32)33-30-23-15-26(16-24-30)11-9-6-4-2/h17,19-22,25-26,30H,3-16,18,23-24H2,1-2H3