ethyl 7,8-bis(chloranyl)-4-methyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 7,8-bis(chloranyl)-4-methyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxylate Openeye Name: ethyl 7,8-dichloro-4-methyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxylate CAS Name: 7,8-dichloro-4-methyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7,8-dichloro-4-methyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxylate Traditional Name: 7,8-dichloro-4-methyl-1-(4-nitrophenyl)-4,5-dihydro-2,3-benzodiazepine-3-carboxylic acid ethyl ester Formula: C19H17Cl2N3O4 MolecularWeight: 422.26198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(CC2=CC(=C(C=C2C(=N1)C3=CC=C(C=C3)[N+](=O)[O-])Cl)Cl)C

Isomeric SMILES

CCOC(=O)N1C(CC2=CC(=C(C=C2C(=N1)C3=CC=C(C=C3)[N+](=O)[O-])Cl)Cl)C

InChI

InChI=1S/C19H17Cl2N3O4/c1-3-28-19(25)23-11(2)8-13-9-16(20)17(21)10-15(13)18(22-23)12-4-6-14(7-5-12)24(26)27/h4-7,9-11H,3,8H2,1-2H3