4-hexyl-1-(4-propylphenyl)cyclohexane-1-carbonitrile

Systemtic Name: 4-hexyl-1-(4-propylphenyl)cyclohexane-1-carbonitrile Openeye Name: 4-hexyl-1-(4-propylphenyl)cyclohexanecarbonitrile CAS Name: 4-hexyl-1-(4-propylphenyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-hexyl-1-(4-propylphenyl)cyclohexane-1-carbonitrile Traditional Name: 4-hexyl-1-(4-propylphenyl)cyclohexanecarbonitrile Formula: C22H33N MolecularWeight: 311.50412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)(C#N)C2=CC=C(C=C2)CCC

Isomeric SMILES

CCCCCCC1CCC(CC1)(C#N)C2=CC=C(C=C2)CCC

InChI

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