ethyl 7-chloranyl-5-(2-chlorophenyl)-1-(methylcarbamoyl)-2-oxidanylidene-3H-1,4-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 7-chloranyl-5-(2-chlorophenyl)-1-(methylcarbamoyl)-2-oxidanylidene-3H-1,4-benzodiazepine-3-carboxylate Openeye Name: ethyl 7-chloro-5-(2-chlorophenyl)-1-(methylcarbamoyl)-2-oxo-3H-1,4-benzodiazepine-3-carboxylate CAS Name: 7-chloro-5-(2-chlorophenyl)-1-(methylcarbamoyl)-2-oxo-3H-1,4-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-5-(2-chlorophenyl)-1-(methylcarbamoyl)-2-oxo-3H-1,4-benzodiazepine-3-carboxylate Traditional Name: 7-chloro-5-(2-chlorophenyl)-2-keto-1-(methylcarbamoyl)-3H-1,4-benzodiazepine-3-carboxylic acid ethyl ester Formula: C20H17Cl2N3O4 MolecularWeight: 434.27268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3Cl)C(=O)NC

Isomeric SMILES

CCOC(=O)C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3Cl)C(=O)NC

InChI

InChI=1S/C20H17Cl2N3O4/c1-3-29-19(27)17-18(26)25(20(28)23-2)15-9-8-11(21)10-13(15)16(24-17)12-6-4-5-7-14(12)22/h4-10,17H,3H2,1-2H3,(H,23,28)