2-[(E)-4-(4-pentylcyclohexyl)but-3-enyl]benzenecarbonitrile

Systemtic Name: 2-[(E)-4-(4-pentylcyclohexyl)but-3-enyl]benzenecarbonitrile Openeye Name: 2-[(E)-4-(4-pentylcyclohexyl)but-3-enyl]benzonitrile CAS Name: 2-[(E)-4-(4-pentylcyclohexyl)but-3-enyl]benzonitrile IUPAC Name: 2-[(E)-4-(4-pentylcyclohexyl)but-3-enyl]benzonitrile Traditional Name: 2-[(E)-4-(4-amylcyclohexyl)but-3-enyl]benzonitrile Formula: C22H31N MolecularWeight: 309.48824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C=CCCC2=CC=CC=C2C#N

Isomeric SMILES

CCCCCC1CCC(CC1)/C=C/CCC2=CC=CC=C2C#N

InChI

InChI=1S/C22H31N/c1-2-3-4-9-19-14-16-20(17-15-19)10-5-6-11-21-12-7-8-13-22(21)18-23/h5,7-8,10,12-13,19-20H,2-4,6,9,11,14-17H2,1H3/b10-5+