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

Systemtic Name: 8-nitro-5-oxidanidyl-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Openeye Name: 8-nitro-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium CAS Name: 8-nitro-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium IUPAC Name: 8-nitro-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Traditional Name: 8-nitro-5-oxido-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Formula: C17H12N4O3 MolecularWeight: 320.30218

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=NC=CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=[N+]1[O-])C4=CC=CC=C4

Isomeric SMILES

C1C2=NC=CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=[N+]1[O-])C4=CC=CC=C4

InChI

InChI=1S/C17H12N4O3/c22-20-11-16-18-8-9-19(16)15-7-6-13(21(23)24)10-14(15)17(20)12-4-2-1-3-5-12/h1-10H,11H2