[4-(2-methylbutyl)phenyl] 4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: [4-(2-methylbutyl)phenyl] 4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: [4-(2-methylbutyl)phenyl] 4-(4-pentylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-pentylcyclohexyl)-1-cyclohexanecarboxylic acid [4-(2-methylbutyl)phenyl] ester IUPAC Name: [4-(2-methylbutyl)phenyl] 4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-amylcyclohexyl)cyclohexanecarboxylic acid [4-(2-methylbutyl)phenyl] ester Formula: C29H46O2 MolecularWeight: 426.67434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC=C(C=C3)CC(C)CC

Isomeric SMILES

CCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC=C(C=C3)CC(C)CC

InChI

InChI=1S/C29H46O2/c1-4-6-7-8-23-9-13-25(14-10-23)26-15-17-27(18-16-26)29(30)31-28-19-11-24(12-20-28)21-22(3)5-2/h11-12,19-20,22-23,25-27H,4-10,13-18,21H2,1-3H3