[6-(4-cyanophenyl)naphthalen-2-yl] 4-pentylcyclohexane-1-carboxylate

Systemtic Name: [6-(4-cyanophenyl)naphthalen-2-yl] 4-pentylcyclohexane-1-carboxylate Openeye Name: [6-(4-cyanophenyl)-2-naphthyl] 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid [6-(4-cyanophenyl)-2-naphthalenyl] ester IUPAC Name: [6-(4-cyanophenyl)naphthalen-2-yl] 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid [6-(4-cyanophenyl)-2-naphthyl] ester Formula: C29H31NO2 MolecularWeight: 425.56194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C29H31NO2/c1-2-3-4-5-21-6-12-24(13-7-21)29(31)32-28-17-16-26-18-25(14-15-27(26)19-28)23-10-8-22(20-30)9-11-23/h8-11,14-19,21,24H,2-7,12-13H2,1H3