(Z)-2-(4-oxidanylidene-1,5-dihydro-1,2-benzodiazepin-5-yl)but-2-enedioate

Systemtic Name: (Z)-2-(4-oxidanylidene-1,5-dihydro-1,2-benzodiazepin-5-yl)but-2-enedioate Openeye Name: (Z)-2-(4-oxo-1,5-dihydro-1,2-benzodiazepin-5-yl)but-2-enedioate CAS Name: (Z)-2-(4-oxo-1,5-dihydro-1,2-benzodiazepin-5-yl)-2-butenedioate IUPAC Name: (Z)-2-(4-oxo-1,5-dihydro-1,2-benzodiazepin-5-yl)but-2-enedioate Traditional Name: (Z)-2-(4-keto-1,5-dihydro-1,2-benzodiazepin-5-yl)but-2-enedioate Formula: C13H8N2O5-2 MolecularWeight: 272.21302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(=O)C=NN2)C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(C(=O)C=NN2)/C(=C/C(=O)[O-])/C(=O)[O-]

InChI

InChI=1S/C13H10N2O5/c16-10-6-14-15-9-4-2-1-3-7(9)12(10)8(13(19)20)5-11(17)18/h1-6,12,15H,(H,17,18)(H,19,20)/p-2/b8-5-