3-pentyl-4-phenyl-benzenecarbonitrile

Systemtic Name: 3-pentyl-4-phenyl-benzenecarbonitrile Openeye Name: 3-pentyl-4-phenyl-benzonitrile CAS Name: 3-pentyl-4-phenylbenzonitrile IUPAC Name: 3-pentyl-4-phenylbenzonitrile Traditional Name: 3-amyl-4-phenyl-benzonitrile Formula: C18H19N MolecularWeight: 249.35016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=CC(=C1)C#N)C2=CC=CC=C2

Isomeric SMILES

CCCCCC1=C(C=CC(=C1)C#N)C2=CC=CC=C2

InChI

InChI=1S/C18H19N/c1-2-3-5-10-17-13-15(14-19)11-12-18(17)16-8-6-4-7-9-16/h4,6-9,11-13H,2-3,5,10H2,1H3