methyl 7-chloranyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylate

Systemtic Name: methyl 7-chloranyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylate Openeye Name: methyl 7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylate CAS Name: 7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylate Traditional Name: 7-chloro-2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylic acid methyl ester Formula: C17H13ClN2O3 MolecularWeight: 328.74972

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3

InChI

InChI=1S/C17H13ClN2O3/c1-23-17(22)15-16(21)19-13-8-7-11(18)9-12(13)14(20-15)10-5-3-2-4-6-10/h2-9,15H,1H3,(H,19,21)