4,5-dimethoxy-2-[(3-oxidanylidene-5-phenyl-cyclohexen-1-yl)amino]benzenecarbonitrile

Systemtic Name: 4,5-dimethoxy-2-[(3-oxidanylidene-5-phenyl-cyclohexen-1-yl)amino]benzenecarbonitrile Openeye Name: 4,5-dimethoxy-2-[(3-oxo-5-phenyl-cyclohexen-1-yl)amino]benzonitrile CAS Name: 4,5-dimethoxy-2-[(3-oxo-5-phenyl-1-cyclohexenyl)amino]benzonitrile IUPAC Name: 4,5-dimethoxy-2-[(3-oxo-5-phenylcyclohexen-1-yl)amino]benzonitrile Traditional Name: 2-[(3-keto-5-phenyl-cyclohexen-1-yl)amino]-4,5-dimethoxy-benzonitrile Formula: C21H20N2O3 MolecularWeight: 348.3951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C#N)NC2=CC(=O)CC(C2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C#N)NC2=CC(=O)CC(C2)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H20N2O3/c1-25-20-10-16(13-22)19(12-21(20)26-2)23-17-8-15(9-18(24)11-17)14-6-4-3-5-7-14/h3-7,10-12,15,23H,8-9H2,1-2H3