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

Systemtic Name: 2-ethyl-6-(2-fluorophenyl)-1-methyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Openeye Name: 2-ethyl-6-(2-fluorophenyl)-1-methyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine CAS Name: 2-ethyl-6-(2-fluorophenyl)-1-methyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine IUPAC Name: 2-ethyl-6-(2-fluorophenyl)-1-methyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Traditional Name: 2-ethyl-6-(2-fluorophenyl)-1-methyl-8-nitro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Formula: C21H18FN3O2 MolecularWeight: 363.384923

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C(=C1)CN=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4F)C

Isomeric SMILES

CCC1=C(N2C(=C1)CN=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4F)C

InChI

InChI=1S/C21H18FN3O2/c1-3-14-10-16-12-23-21(17-6-4-5-7-19(17)22)18-11-15(25(26)27)8-9-20(18)24(16)13(14)2/h4-11H,3,12H2,1-2H3