2-[4-(4-pentylcyclohexyl)butyl]benzenecarbonitrile

Systemtic Name: 2-[4-(4-pentylcyclohexyl)butyl]benzenecarbonitrile Openeye Name: 2-[4-(4-pentylcyclohexyl)butyl]benzonitrile CAS Name: 2-[4-(4-pentylcyclohexyl)butyl]benzonitrile IUPAC Name: 2-[4-(4-pentylcyclohexyl)butyl]benzonitrile Traditional Name: 2-[4-(4-amylcyclohexyl)butyl]benzonitrile Formula: C22H33N MolecularWeight: 311.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCCCC2=CC=CC=C2C#N

Isomeric SMILES

CCCCCC1CCC(CC1)CCCCC2=CC=CC=C2C#N

InChI

InChI=1S/C22H33N/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/h7-8,12-13,19-20H,2-6,9-11,14-17H2,1H3