4-butyl-1-(4-methoxyphenyl)cyclohexane-1-carbonitrile

Systemtic Name: 4-butyl-1-(4-methoxyphenyl)cyclohexane-1-carbonitrile Openeye Name: 4-butyl-1-(4-methoxyphenyl)cyclohexanecarbonitrile CAS Name: 4-butyl-1-(4-methoxyphenyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-butyl-1-(4-methoxyphenyl)cyclohexane-1-carbonitrile Traditional Name: 4-butyl-1-(4-methoxyphenyl)cyclohexanecarbonitrile Formula: C18H25NO MolecularWeight: 271.3972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)(C#N)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCC1CCC(CC1)(C#N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H25NO/c1-3-4-5-15-10-12-18(14-19,13-11-15)16-6-8-17(20-2)9-7-16/h6-9,15H,3-5,10-13H2,1-2H3