(4-pentylcyclohexyl) 4-[4-(2-methylbutyl)phenyl]benzoate

Systemtic Name: (4-pentylcyclohexyl) 4-[4-(2-methylbutyl)phenyl]benzoate Openeye Name: (4-pentylcyclohexyl) 4-[4-(2-methylbutyl)phenyl]benzoate CAS Name: 4-[4-(2-methylbutyl)phenyl]benzoic acid (4-pentylcyclohexyl) ester IUPAC Name: (4-pentylcyclohexyl) 4-[4-(2-methylbutyl)phenyl]benzoate Traditional Name: 4-[4-(2-methylbutyl)phenyl]benzoic acid (4-amylcyclohexyl) ester Formula: C29H40O2 MolecularWeight: 420.6267

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CC(C)CC

Isomeric SMILES

CCCCCC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CC(C)CC

InChI

InChI=1S/C29H40O2/c1-4-6-7-8-23-11-19-28(20-12-23)31-29(30)27-17-15-26(16-18-27)25-13-9-24(10-14-25)21-22(3)5-2/h9-10,13-18,22-23,28H,4-8,11-12,19-21H2,1-3H3