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

Systemtic Name: 2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]-3,5-dimethyl-benzenecarbonitrile hydrochloride Openeye Name: 2-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]-3,5-dimethyl-benzonitrile hydrochloride CAS Name: 2-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]-3,5-dimethylbenzonitrile hydrochloride IUPAC Name: 2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]-3,5-dimethylbenzonitrile hydrochloride Traditional Name: 2-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]-3,5-dimethyl-benzonitrile hydrochloride Formula: C17H21ClN2O MolecularWeight: 304.81444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O.ClH/c1-11-5-12(2)16(13(6-11)10-18)19-14-7-15(20)9-17(3,4)8-14;/h5-7,19H,8-9H2,1-4H3;1H