3-(3,4-dimethoxyphenyl)-4-oxidanylidene-cyclohexane-1-carbonitrile

Systemtic Name: 3-(3,4-dimethoxyphenyl)-4-oxidanylidene-cyclohexane-1-carbonitrile Openeye Name: 3-(3,4-dimethoxyphenyl)-4-oxo-cyclohexanecarbonitrile CAS Name: 3-(3,4-dimethoxyphenyl)-4-oxo-1-cyclohexanecarbonitrile IUPAC Name: 3-(3,4-dimethoxyphenyl)-4-oxocyclohexane-1-carbonitrile Traditional Name: 3-(3,4-dimethoxyphenyl)-4-keto-cyclohexanecarbonitrile Formula: C15H17NO3 MolecularWeight: 259.30038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(CCC2=O)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(CCC2=O)C#N)OC

InChI

InChI=1S/C15H17NO3/c1-18-14-6-4-11(8-15(14)19-2)12-7-10(9-16)3-5-13(12)17/h4,6,8,10,12H,3,5,7H2,1-2H3