5-butyl-2-(4-pentylphenyl)cyclohexane-1-carbonitrile

Systemtic Name: 5-butyl-2-(4-pentylphenyl)cyclohexane-1-carbonitrile Openeye Name: 5-butyl-2-(4-pentylphenyl)cyclohexanecarbonitrile CAS Name: 5-butyl-2-(4-pentylphenyl)-1-cyclohexanecarbonitrile IUPAC Name: 5-butyl-2-(4-pentylphenyl)cyclohexane-1-carbonitrile Traditional Name: 2-(4-amylphenyl)-5-butyl-cyclohexanecarbonitrile Formula: C22H33N MolecularWeight: 311.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2CCC(CC2C#N)CCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2CCC(CC2C#N)CCCC

InChI

InChI=1S/C22H33N/c1-3-5-7-9-18-10-13-20(14-11-18)22-15-12-19(8-6-4-2)16-21(22)17-23/h10-11,13-14,19,21-22H,3-9,12,15-16H2,1-2H3