1-(2-chloranyl-4-nitro-phenyl)-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine

Systemtic Name: 1-(2-chloranyl-4-nitro-phenyl)-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine Openeye Name: 1-(2-chloro-4-nitro-phenyl)-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine CAS Name: 1-(2-chloro-4-nitrophenyl)-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine IUPAC Name: 1-(2-chloro-4-nitrophenyl)-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine Traditional Name: 1-(2-chloro-4-nitro-phenyl)-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine Formula: C18H16ClN3O4 MolecularWeight: 373.79034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=CC(=C(C=C2C1)OC)OC)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=NN=C(C2=CC(=C(C=C2C1)OC)OC)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H16ClN3O4/c1-10-6-11-7-16(25-2)17(26-3)9-14(11)18(21-20-10)13-5-4-12(22(23)24)8-15(13)19/h4-5,7-9H,6H2,1-3H3