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

Systemtic Name: ethyl 1-(4-aminophenyl)-7,8-bis(chloranyl)-4-methyl-4,5-dihydro-2,3-benzodiazepine-3-carboxylate Openeye Name: ethyl 1-(4-aminophenyl)-7,8-dichloro-4-methyl-4,5-dihydro-2,3-benzodiazepine-3-carboxylate CAS Name: 1-(4-aminophenyl)-7,8-dichloro-4-methyl-4,5-dihydro-2,3-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-aminophenyl)-7,8-dichloro-4-methyl-4,5-dihydro-2,3-benzodiazepine-3-carboxylate Traditional Name: 1-(4-aminophenyl)-7,8-dichloro-4-methyl-4,5-dihydro-2,3-benzodiazepine-3-carboxylic acid ethyl ester Formula: C19H19Cl2N3O2 MolecularWeight: 392.27906

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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)Cl)Cl)C

Isomeric SMILES

CCOC(=O)N1C(CC2=CC(=C(C=C2C(=N1)C3=CC=C(C=C3)N)Cl)Cl)C

InChI

InChI=1S/C19H19Cl2N3O2/c1-3-26-19(25)24-11(2)8-13-9-16(20)17(21)10-15(13)18(23-24)12-4-6-14(22)7-5-12/h4-7,9-11H,3,8,22H2,1-2H3