(3E)-3-[methoxy(oxidanyl)methylidene]-1-(3-methylphenyl)-4-oxidanylidene-cyclohexane-1-carbonitrile

Systemtic Name: (3E)-3-[methoxy(oxidanyl)methylidene]-1-(3-methylphenyl)-4-oxidanylidene-cyclohexane-1-carbonitrile Openeye Name: (3E)-3-[hydroxy(methoxy)methylene]-1-(m-tolyl)-4-oxo-cyclohexanecarbonitrile CAS Name: (3E)-3-[hydroxy(methoxy)methylidene]-1-(3-methylphenyl)-4-oxo-1-cyclohexanecarbonitrile IUPAC Name: (3E)-3-[hydroxy(methoxy)methylidene]-1-(3-methylphenyl)-4-oxocyclohexane-1-carbonitrile Traditional Name: (3E)-3-[hydroxy(methoxy)methylene]-4-keto-1-(m-tolyl)cyclohexanecarbonitrile Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2(CCC(=O)C(=C(O)OC)C2)C#N

Isomeric SMILES

CC1=CC=CC(=C1)C2(CCC(=O)/C(=C(\O)/OC)/C2)C#N

InChI

InChI=1S/C16H17NO3/c1-11-4-3-5-12(8-11)16(10-17)7-6-14(18)13(9-16)15(19)20-2/h3-5,8,19H,6-7,9H2,1-2H3/b15-13+