[4-(4-heptylphenyl)phenyl] 4-(4-methylpentyl)cyclohex-2-ene-1-carboxylate

Systemtic Name: [4-(4-heptylphenyl)phenyl] 4-(4-methylpentyl)cyclohex-2-ene-1-carboxylate Openeye Name: [4-(4-heptylphenyl)phenyl] 4-isohexylcyclohex-2-ene-1-carboxylate CAS Name: 4-(4-methylpentyl)-1-cyclohex-2-enecarboxylic acid [4-(4-heptylphenyl)phenyl] ester IUPAC Name: [4-(4-heptylphenyl)phenyl] 4-(4-methylpentyl)cyclohex-2-ene-1-carboxylate Traditional Name: 4-isohexylcyclohex-2-ene-1-carboxylic acid [4-(4-heptylphenyl)phenyl] ester Formula: C32H44O2 MolecularWeight: 460.69056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3CCC(C=C3)CCCC(C)C

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3CCC(C=C3)CCCC(C)C

InChI

InChI=1S/C32H44O2/c1-4-5-6-7-8-11-26-13-17-28(18-14-26)29-21-23-31(24-22-29)34-32(33)30-19-15-27(16-20-30)12-9-10-25(2)3/h13-15,17-19,21-25,27,30H,4-12,16,20H2,1-3H3