6-(2-fluorophenyl)-1,2-dimethyl-8-nitro-5-oxidanidyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium

Systemtic Name: 6-(2-fluorophenyl)-1,2-dimethyl-8-nitro-5-oxidanidyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Openeye Name: 6-(2-fluorophenyl)-1,2-dimethyl-8-nitro-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium CAS Name: 6-(2-fluorophenyl)-1,2-dimethyl-8-nitro-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium IUPAC Name: 6-(2-fluorophenyl)-1,2-dimethyl-8-nitro-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Traditional Name: 6-(2-fluorophenyl)-1,2-dimethyl-8-nitro-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Formula: C19H15FN4O3 MolecularWeight: 366.345803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=N1)C[N+](=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4F)[O-])C

Isomeric SMILES

CC1=C(N2C(=N1)C[N+](=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4F)[O-])C

InChI

InChI=1S/C19H15FN4O3/c1-11-12(2)23-17-8-7-13(24(26)27)9-15(17)19(22(25)10-18(23)21-11)14-5-3-4-6-16(14)20/h3-9H,10H2,1-2H3