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

Systemtic Name: 3-(4-butylphenyl)-2-(4-heptylcyclohexyl)propanenitrile Openeye Name: 3-(4-butylphenyl)-2-(4-heptylcyclohexyl)propanenitrile CAS Name: 3-(4-butylphenyl)-2-(4-heptylcyclohexyl)propanenitrile IUPAC Name: 3-(4-butylphenyl)-2-(4-heptylcyclohexyl)propanenitrile Traditional Name: 3-(4-butylphenyl)-2-(4-heptylcyclohexyl)propionitrile Formula: C26H41N MolecularWeight: 367.61044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C(CC2=CC=C(C=C2)CCCC)C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)C(CC2=CC=C(C=C2)CCCC)C#N

InChI

InChI=1S/C26H41N/c1-3-5-7-8-9-11-23-16-18-25(19-17-23)26(21-27)20-24-14-12-22(13-15-24)10-6-4-2/h12-15,23,25-26H,3-11,16-20H2,1-2H3