4-[3-(4-pentylcyclohexyl)propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-(4-pentylcyclohexyl)propoxy]benzenecarbonitrile Openeye Name: 4-[3-(4-pentylcyclohexyl)propoxy]benzonitrile CAS Name: 4-[3-(4-pentylcyclohexyl)propoxy]benzonitrile IUPAC Name: 4-[3-(4-pentylcyclohexyl)propoxy]benzonitrile Traditional Name: 4-[3-(4-amylcyclohexyl)propoxy]benzonitrile Formula: C21H31NO MolecularWeight: 313.47694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H31NO/c1-2-3-4-6-18-8-10-19(11-9-18)7-5-16-23-21-14-12-20(17-22)13-15-21/h12-15,18-19H,2-11,16H2,1H3