(2E)-4-oxidanylidene-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,5-dihydro-1,5-benzodiazepine-7-carboxylic acid

Systemtic Name: (2E)-4-oxidanylidene-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,5-dihydro-1,5-benzodiazepine-7-carboxylic acid Openeye Name: (2E)-4-oxo-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,5-dihydro-1,5-benzodiazepine-7-carboxylic acid CAS Name: (2E)-4-oxo-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1,5-dihydro-1,5-benzodiazepine-7-carboxylic acid IUPAC Name: (2E)-4-oxo-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,5-dihydro-1,5-benzodiazepine-7-carboxylic acid Traditional Name: (2E)-4-keto-2-(6-ketocyclohexa-2,4-dien-1-ylidene)-1,5-dihydro-1,5-benzodiazepine-7-carboxylic acid Formula: C16H12N2O4 MolecularWeight: 296.27748

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C2C=CC=CC2=O)NC3=C(C=C(C=C3)C(=O)O)NC1=O

Isomeric SMILES

C1/C(=C\2/C=CC=CC2=O)/NC3=C(C=C(C=C3)C(=O)O)NC1=O

InChI

InChI=1S/C16H12N2O4/c19-14-4-2-1-3-10(14)12-8-15(20)18-13-7-9(16(21)22)5-6-11(13)17-12/h1-7,17H,8H2,(H,18,20)(H,21,22)/b12-10+