3-(6,8-dimethoxy-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-5-yl)benzenecarbonitrile

Systemtic Name: 3-(6,8-dimethoxy-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-5-yl)benzenecarbonitrile Openeye Name: 3-(6,8-dimethoxy-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)benzonitrile CAS Name: 3-(6,8-dimethoxy-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)benzonitrile IUPAC Name: 3-(6,8-dimethoxy-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)benzonitrile Traditional Name: 3-(2-keto-6,8-dimethoxy-1-methyl-3H-1,4-benzodiazepin-5-yl)benzonitrile Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN=C(C2=C(C=C(C=C21)OC)OC)C3=CC=CC(=C3)C#N

Isomeric SMILES

CN1C(=O)CN=C(C2=C(C=C(C=C21)OC)OC)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H17N3O3/c1-22-15-8-14(24-2)9-16(25-3)18(15)19(21-11-17(22)23)13-6-4-5-12(7-13)10-20/h4-9H,11H2,1-3H3