2-[(E)-4-(4-pentylcyclohexyl)but-1-enyl]benzenecarbonitrile

Systemtic Name: 2-[(E)-4-(4-pentylcyclohexyl)but-1-enyl]benzenecarbonitrile Openeye Name: 2-[(E)-4-(4-pentylcyclohexyl)but-1-enyl]benzonitrile CAS Name: 2-[(E)-4-(4-pentylcyclohexyl)but-1-enyl]benzonitrile IUPAC Name: 2-[(E)-4-(4-pentylcyclohexyl)but-1-enyl]benzonitrile Traditional Name: 2-[(E)-4-(4-amylcyclohexyl)but-1-enyl]benzonitrile Formula: C22H31N MolecularWeight: 309.48824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCC=CC2=CC=CC=C2C#N

Isomeric SMILES

CCCCCC1CCC(CC1)CC/C=C/C2=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/h6-8,11-13,19-20H,2-5,9-10,14-17H2,1H3/b11-6+