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

Systemtic Name: [4-(2-methylbutyl)phenyl] 4-(4-heptylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: [4-(2-methylbutyl)phenyl] 4-(4-heptylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-heptylcyclohexyl)-1-cyclohexanecarboxylic acid [4-(2-methylbutyl)phenyl] ester IUPAC Name: [4-(2-methylbutyl)phenyl] 4-(4-heptylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-heptylcyclohexyl)cyclohexanecarboxylic acid [4-(2-methylbutyl)phenyl] ester Formula: C31H50O2 MolecularWeight: 454.7275

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC=C(C=C3)CC(C)CC

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=CC=C(C=C3)CC(C)CC

InChI

InChI=1S/C31H50O2/c1-4-6-7-8-9-10-25-11-15-27(16-12-25)28-17-19-29(20-18-28)31(32)33-30-21-13-26(14-22-30)23-24(3)5-2/h13-14,21-22,24-25,27-29H,4-12,15-20,23H2,1-3H3