2-methyl-8-nitro-5-oxidanidyl-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium

Systemtic Name: 2-methyl-8-nitro-5-oxidanidyl-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Openeye Name: 2-methyl-8-nitro-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium CAS Name: 2-methyl-8-nitro-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium IUPAC Name: 2-methyl-8-nitro-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Traditional Name: 2-methyl-8-nitro-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Formula: C18H14N4O3 MolecularWeight: 334.32876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=N1)C[N+](=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4)[O-]

Isomeric SMILES

CC1=CN2C(=N1)C[N+](=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4)[O-]

InChI

InChI=1S/C18H14N4O3/c1-12-10-20-16-8-7-14(22(24)25)9-15(16)18(13-5-3-2-4-6-13)21(23)11-17(20)19-12/h2-10H,11H2,1H3