3-(6,8-dimethoxy-2-oxidanylidene-7-phenyl-1,3-dihydro-1,4-benzodiazepin-5-yl)benzenecarbonitrile

Systemtic Name: 3-(6,8-dimethoxy-2-oxidanylidene-7-phenyl-1,3-dihydro-1,4-benzodiazepin-5-yl)benzenecarbonitrile Openeye Name: 3-(6,8-dimethoxy-2-oxo-7-phenyl-1,3-dihydro-1,4-benzodiazepin-5-yl)benzonitrile CAS Name: 3-(6,8-dimethoxy-2-oxo-7-phenyl-1,3-dihydro-1,4-benzodiazepin-5-yl)benzonitrile IUPAC Name: 3-(6,8-dimethoxy-2-oxo-7-phenyl-1,3-dihydro-1,4-benzodiazepin-5-yl)benzonitrile Traditional Name: 3-(2-keto-6,8-dimethoxy-7-phenyl-1,3-dihydro-1,4-benzodiazepin-5-yl)benzonitrile Formula: C24H19N3O3 MolecularWeight: 397.42596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)NC(=O)CN=C2C3=CC=CC(=C3)C#N)OC)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=C2C(=C1)NC(=O)CN=C2C3=CC=CC(=C3)C#N)OC)C4=CC=CC=C4

InChI

InChI=1S/C24H19N3O3/c1-29-19-12-18-22(24(30-2)21(19)16-8-4-3-5-9-16)23(26-14-20(28)27-18)17-10-6-7-15(11-17)13-25/h3-12H,14H2,1-2H3,(H,27,28)