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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCCC(=O)C2)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCCC(=O)C2)C#N)OC

InChI

InChI=1S/C15H17NO3/c1-18-13-6-5-11(8-14(13)19-2)15(10-16)7-3-4-12(17)9-15/h5-6,8H,3-4,7,9H2,1-2H3