phenyl 4-(4-heptylcyclohexyl)-4-methyl-cyclohexane-1-carboxylate

Systemtic Name: phenyl 4-(4-heptylcyclohexyl)-4-methyl-cyclohexane-1-carboxylate Openeye Name: phenyl 4-(4-heptylcyclohexyl)-4-methyl-cyclohexanecarboxylate CAS Name: 4-(4-heptylcyclohexyl)-4-methyl-1-cyclohexanecarboxylic acid phenyl ester IUPAC Name: phenyl 4-(4-heptylcyclohexyl)-4-methylcyclohexane-1-carboxylate Traditional Name: 4-(4-heptylcyclohexyl)-4-methyl-cyclohexanecarboxylic acid phenyl ester Formula: C27H42O2 MolecularWeight: 398.62118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2(CCC(CC2)C(=O)OC3=CC=CC=C3)C

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2(CCC(CC2)C(=O)OC3=CC=CC=C3)C

InChI

InChI=1S/C27H42O2/c1-3-4-5-6-8-11-22-14-16-24(17-15-22)27(2)20-18-23(19-21-27)26(28)29-25-12-9-7-10-13-25/h7,9-10,12-13,22-24H,3-6,8,11,14-21H2,1-2H3