2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]-4-methoxy-benzenecarbonitrile hydrochloride

Systemtic Name: 2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]-4-methoxy-benzenecarbonitrile hydrochloride Openeye Name: 2-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]-4-methoxy-benzonitrile hydrochloride CAS Name: 2-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]-4-methoxybenzonitrile hydrochloride IUPAC Name: 2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]-4-methoxybenzonitrile hydrochloride Traditional Name: 2-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]-4-methoxy-benzonitrile hydrochloride Formula: C16H19ClN2O2 MolecularWeight: 306.78726

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NC2=C(C=CC(=C2)OC)C#N)C.Cl

Isomeric SMILES

CC1(CC(=CC(=O)C1)NC2=C(C=CC(=C2)OC)C#N)C.Cl

InChI

InChI=1S/C16H18N2O2.ClH/c1-16(2)8-12(6-13(19)9-16)18-15-7-14(20-3)5-4-11(15)10-17;/h4-7,18H,8-9H2,1-3H3;1H