3-(4-butylphenyl)-2-(4-propylcyclohexyl)propanenitrile

Systemtic Name: 3-(4-butylphenyl)-2-(4-propylcyclohexyl)propanenitrile Openeye Name: 3-(4-butylphenyl)-2-(4-propylcyclohexyl)propanenitrile CAS Name: 3-(4-butylphenyl)-2-(4-propylcyclohexyl)propanenitrile IUPAC Name: 3-(4-butylphenyl)-2-(4-propylcyclohexyl)propanenitrile Traditional Name: 3-(4-butylphenyl)-2-(4-propylcyclohexyl)propionitrile Formula: C22H33N MolecularWeight: 311.50412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC(C#N)C2CCC(CC2)CCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC(C#N)C2CCC(CC2)CCC

InChI

InChI=1S/C22H33N/c1-3-5-7-19-8-10-20(11-9-19)16-22(17-23)21-14-12-18(6-4-2)13-15-21/h8-11,18,21-22H,3-7,12-16H2,1-2H3