ethyl 5-oxidanylidene-4H-1,3,4-benzoxadiazepine-2-carboxylate

Systemtic Name: ethyl 5-oxidanylidene-4H-1,3,4-benzoxadiazepine-2-carboxylate Openeye Name: ethyl 5-oxo-4H-1,3,4-benzoxadiazepine-2-carboxylate CAS Name: 5-oxo-4H-1,3,4-benzoxadiazepine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-oxo-4H-1,3,4-benzoxadiazepine-2-carboxylate Traditional Name: 5-keto-4H-1,3,4-benzoxadiazepine-2-carboxylic acid ethyl ester Formula: C11H10N2O4 MolecularWeight: 234.2081

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC(=O)C2=CC=CC=C2O1

Isomeric SMILES

CCOC(=O)C1=NNC(=O)C2=CC=CC=C2O1

InChI

InChI=1S/C11H10N2O4/c1-2-16-11(15)10-13-12-9(14)7-5-3-4-6-8(7)17-10/h3-6H,2H2,1H3,(H,12,14)