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

Systemtic Name: 6-(2-chlorophenyl)-2-ethyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Openeye Name: 6-(2-chlorophenyl)-2-ethyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine CAS Name: 6-(2-chlorophenyl)-2-ethyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine IUPAC Name: 6-(2-chlorophenyl)-2-ethyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Traditional Name: 6-(2-chlorophenyl)-2-ethyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Formula: C20H16ClN3O2 MolecularWeight: 365.81294

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN2C(=C1)CN=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4Cl

Isomeric SMILES

CCC1=CN2C(=C1)CN=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4Cl

InChI

InChI=1S/C20H16ClN3O2/c1-2-13-9-15-11-22-20(16-5-3-4-6-18(16)21)17-10-14(24(25)26)7-8-19(17)23(15)12-13/h3-10,12H,2,11H2,1H3