2-[(3Z)-3-hydroxyimino-2-oxidanylidene-5-phenyl-1,4-benzodiazepin-1-yl]ethanoic acid

Systemtic Name: 2-[(3Z)-3-hydroxyimino-2-oxidanylidene-5-phenyl-1,4-benzodiazepin-1-yl]ethanoic acid Openeye Name: 2-[(3Z)-3-hydroxyimino-2-oxo-5-phenyl-1,4-benzodiazepin-1-yl]acetic acid CAS Name: 2-[(3Z)-3-hydroxyimino-2-oxo-5-phenyl-1,4-benzodiazepin-1-yl]acetic acid IUPAC Name: 2-[(3Z)-3-hydroxyimino-2-oxo-5-phenyl-1,4-benzodiazepin-1-yl]acetic acid Traditional Name: 2-[(3Z)-3-hydroximino-2-keto-5-phenyl-1,4-benzodiazepin-1-yl]acetic acid Formula: C17H13N3O4 MolecularWeight: 323.30282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NO)C(=O)N(C3=CC=CC=C32)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=N/C(=N\O)/C(=O)N(C3=CC=CC=C32)CC(=O)O

InChI

InChI=1S/C17H13N3O4/c21-14(22)10-20-13-9-5-4-8-12(13)15(11-6-2-1-3-7-11)18-16(19-24)17(20)23/h1-9,24H,10H2,(H,21,22)/b19-16-