methyl 4-oxidanylidene-3,5-dihydro-2,3-benzodiazepine-1-carboxylate

Systemtic Name: methyl 4-oxidanylidene-3,5-dihydro-2,3-benzodiazepine-1-carboxylate Openeye Name: methyl 4-oxo-3,5-dihydro-2,3-benzodiazepine-1-carboxylate CAS Name: 4-oxo-3,5-dihydro-2,3-benzodiazepine-1-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-3,5-dihydro-2,3-benzodiazepine-1-carboxylate Traditional Name: 4-keto-3,5-dihydro-2,3-benzodiazepine-1-carboxylic acid methyl ester Formula: C11H10N2O3 MolecularWeight: 218.2087

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NNC(=O)CC2=CC=CC=C21

Isomeric SMILES

COC(=O)C1=NNC(=O)CC2=CC=CC=C21

InChI

InChI=1S/C11H10N2O3/c1-16-11(15)10-8-5-3-2-4-7(8)6-9(14)12-13-10/h2-5H,6H2,1H3,(H,12,14)