[4-[2-(4-pentylcyclohex-3-en-1-yl)ethyl]phenyl] 4-methylcyclohex-3-ene-1-carboxylate

Systemtic Name: [4-[2-(4-pentylcyclohex-3-en-1-yl)ethyl]phenyl] 4-methylcyclohex-3-ene-1-carboxylate Openeye Name: [4-[2-(4-pentylcyclohex-3-en-1-yl)ethyl]phenyl] 4-methylcyclohex-3-ene-1-carboxylate CAS Name: 4-methyl-1-cyclohex-3-enecarboxylic acid [4-[2-(4-pentyl-1-cyclohex-3-enyl)ethyl]phenyl] ester IUPAC Name: [4-[2-(4-pentylcyclohex-3-en-1-yl)ethyl]phenyl] 4-methylcyclohex-3-ene-1-carboxylate Traditional Name: 4-methylcyclohex-3-ene-1-carboxylic acid [4-[2-(4-amylcyclohex-3-en-1-yl)ethyl]phenyl] ester Formula: C27H38O2 MolecularWeight: 394.58942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CCC(CC1)CCC2=CC=C(C=C2)OC(=O)C3CCC(=CC3)C

Isomeric SMILES

CCCCCC1=CCC(CC1)CCC2=CC=C(C=C2)OC(=O)C3CCC(=CC3)C

InChI

InChI=1S/C27H38O2/c1-3-4-5-6-22-9-11-23(12-10-22)13-14-24-15-19-26(20-16-24)29-27(28)25-17-7-21(2)8-18-25/h7,9,15-16,19-20,23,25H,3-6,8,10-14,17-18H2,1-2H3