6-(2-chlorophenyl)-3-ethyl-1-methyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine

Systemtic Name: 6-(2-chlorophenyl)-3-ethyl-1-methyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Openeye Name: 6-(2-chlorophenyl)-3-ethyl-1-methyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine CAS Name: 6-(2-chlorophenyl)-3-ethyl-1-methyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine IUPAC Name: 6-(2-chlorophenyl)-3-ethyl-1-methyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Traditional Name: 6-(2-chlorophenyl)-3-ethyl-1-methyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Formula: C21H18ClN3O2 MolecularWeight: 379.83952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2CN=C(C3=C(N2C(=C1)C)C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4Cl

Isomeric SMILES

CCC1=C2CN=C(C3=C(N2C(=C1)C)C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4Cl

InChI

InChI=1S/C21H18ClN3O2/c1-3-14-10-13(2)24-19-9-8-15(25(26)27)11-17(19)21(23-12-20(14)24)16-6-4-5-7-18(16)22/h4-11H,3,12H2,1-2H3