7-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,2,3,4-tetrahydro-1,4-diazepine-5-carboxylic acid

Systemtic Name: 7-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,2,3,4-tetrahydro-1,4-diazepine-5-carboxylic acid Openeye Name: 7-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2,3,4-tetrahydro-1,4-diazepine-5-carboxylic acid CAS Name: 7-(6-oxo-1-cyclohexa-2,4-dienylidene)-1,2,3,4-tetrahydro-1,4-diazepine-5-carboxylic acid IUPAC Name: 7-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2,3,4-tetrahydro-1,4-diazepine-5-carboxylic acid Traditional Name: 7-(6-ketocyclohexa-2,4-dien-1-ylidene)-1,2,3,4-tetrahydro-1,4-diazepine-5-carboxylic acid Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=C2C=CC=CC2=O)C=C(N1)C(=O)O

Isomeric SMILES

C1CNC(=C2C=CC=CC2=O)C=C(N1)C(=O)O

InChI

InChI=1S/C12H12N2O3/c15-11-4-2-1-3-8(11)9-7-10(12(16)17)14-6-5-13-9/h1-4,7,13-14H,5-6H2,(H,16,17)