4,4-dimethyl-6-oxidanylidene-2-[(phenylmethyl)amino]cyclohexene-1-carbonitrile

Systemtic Name: 4,4-dimethyl-6-oxidanylidene-2-[(phenylmethyl)amino]cyclohexene-1-carbonitrile Openeye Name: 2-(benzylamino)-4,4-dimethyl-6-oxo-cyclohexene-1-carbonitrile CAS Name: 4,4-dimethyl-6-oxo-2-[(phenylmethyl)amino]-1-cyclohexenecarbonitrile IUPAC Name: 2-(benzylamino)-4,4-dimethyl-6-oxocyclohexene-1-carbonitrile Traditional Name: 2-(benzylamino)-6-keto-4,4-dimethyl-cyclohexene-1-carbonitrile Formula: C16H18N2O MolecularWeight: 254.32692

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C#N)NCC2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C#N)NCC2=CC=CC=C2)C

InChI

InChI=1S/C16H18N2O/c1-16(2)8-14(13(10-17)15(19)9-16)18-11-12-6-4-3-5-7-12/h3-7,18H,8-9,11H2,1-2H3