2-(4-methylphenyl)-3-oxidanyl-5-oxidanylidene-2,4-dihydro-1H-1,4-benzodiazepine-3-carbonitrile

Systemtic Name: 2-(4-methylphenyl)-3-oxidanyl-5-oxidanylidene-2,4-dihydro-1H-1,4-benzodiazepine-3-carbonitrile Openeye Name: 3-hydroxy-5-oxo-2-(p-tolyl)-2,4-dihydro-1H-1,4-benzodiazepine-3-carbonitrile CAS Name: 3-hydroxy-2-(4-methylphenyl)-5-oxo-2,4-dihydro-1H-1,4-benzodiazepine-3-carbonitrile IUPAC Name: 3-hydroxy-2-(4-methylphenyl)-5-oxo-2,4-dihydro-1H-1,4-benzodiazepine-3-carbonitrile Traditional Name: 3-hydroxy-5-keto-2-(p-tolyl)-2,4-dihydro-1H-1,4-benzodiazepine-3-carbonitrile Formula: C17H15N3O2 MolecularWeight: 293.3199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(NC(=O)C3=CC=CC=C3N2)(C#N)O

Isomeric SMILES

CC1=CC=C(C=C1)C2C(NC(=O)C3=CC=CC=C3N2)(C#N)O

InChI

InChI=1S/C17H15N3O2/c1-11-6-8-12(9-7-11)15-17(22,10-18)20-16(21)13-4-2-3-5-14(13)19-15/h2-9,15,19,22H,1H3,(H,20,21)