4-chloranyl-9,11-dimethyl-6-(4-nitrophenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzodiazepine

Systemtic Name: 4-chloranyl-9,11-dimethyl-6-(4-nitrophenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzodiazepine Openeye Name: 4-chloro-9,11-dimethyl-6-(4-nitrophenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzodiazepine CAS Name: 4-chloro-9,11-dimethyl-6-(4-nitrophenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzodiazepine IUPAC Name: 4-chloro-9,11-dimethyl-6-(4-nitrophenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzodiazepine Traditional Name: 4-chloro-9,11-dimethyl-6-(4-nitrophenyl)-5,6-dihydropyrimido[4,5-b][1,4]benzodiazepine Formula: C19H16ClN5O2 MolecularWeight: 381.81564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(NC3=C(N2C)N=CN=C3Cl)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)C(NC3=C(N2C)N=CN=C3Cl)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H16ClN5O2/c1-11-3-8-14-15(9-11)24(2)19-17(18(20)21-10-22-19)23-16(14)12-4-6-13(7-5-12)25(26)27/h3-10,16,23H,1-2H3