[4-[4-(4-butyl-4-cyano-cyclohexyl)phenyl]phenyl] nonanoate

Systemtic Name: [4-[4-(4-butyl-4-cyano-cyclohexyl)phenyl]phenyl] nonanoate Openeye Name: [4-[4-(4-butyl-4-cyano-cyclohexyl)phenyl]phenyl] nonanoate CAS Name: nonanoic acid [4-[4-(4-butyl-4-cyanocyclohexyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(4-butyl-4-cyanocyclohexyl)phenyl]phenyl] nonanoate Traditional Name: pelargonic acid [4-[4-(4-butyl-4-cyano-cyclohexyl)phenyl]phenyl] ester Formula: C32H43NO2 MolecularWeight: 473.68932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(CCCC)C#N

Isomeric SMILES

CCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(CCCC)C#N

InChI

InChI=1S/C32H43NO2/c1-3-5-7-8-9-10-11-31(34)35-30-18-16-28(17-19-30)26-12-14-27(15-13-26)29-20-23-32(25-33,24-21-29)22-6-4-2/h12-19,29H,3-11,20-24H2,1-2H3