ethyl 7-bromanyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzodiazepine-1-carboxylate

Systemtic Name: ethyl 7-bromanyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzodiazepine-1-carboxylate Openeye Name: ethyl 7-bromo-5-oxo-3,4-dihydro-2H-1,4-benzodiazepine-1-carboxylate CAS Name: 7-bromo-5-oxo-3,4-dihydro-2H-1,4-benzodiazepine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 7-bromo-5-oxo-3,4-dihydro-2H-1,4-benzodiazepine-1-carboxylate Traditional Name: 7-bromo-5-keto-3,4-dihydro-2H-1,4-benzodiazepine-1-carboxylic acid ethyl ester Formula: C12H13BrN2O3 MolecularWeight: 313.14722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCNC(=O)C2=C1C=CC(=C2)Br

Isomeric SMILES

CCOC(=O)N1CCNC(=O)C2=C1C=CC(=C2)Br

InChI

InChI=1S/C12H13BrN2O3/c1-2-18-12(17)15-6-5-14-11(16)9-7-8(13)3-4-10(9)15/h3-4,7H,2,5-6H2,1H3,(H,14,16)