4-(4-octylcyclohexyl)benzenecarbonitrile

Systemtic Name: 4-(4-octylcyclohexyl)benzenecarbonitrile Openeye Name: 4-(4-octylcyclohexyl)benzonitrile CAS Name: 4-(4-octylcyclohexyl)benzonitrile IUPAC Name: 4-(4-octylcyclohexyl)benzonitrile Traditional Name: 4-(4-octylcyclohexyl)benzonitrile Formula: C21H31N MolecularWeight: 297.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H31N/c1-2-3-4-5-6-7-8-18-9-13-20(14-10-18)21-15-11-19(17-22)12-16-21/h11-12,15-16,18,20H,2-10,13-14H2,1H3