5-methyl-2-(4-nitrophenyl)-1-oxidanidyl-3-oxidanyl-4-phenyl-imidazol-1-ium

Systemtic Name: 5-methyl-2-(4-nitrophenyl)-1-oxidanidyl-3-oxidanyl-4-phenyl-imidazol-1-ium Openeye Name: 1-hydroxy-4-methyl-2-(4-nitrophenyl)-3-oxido-5-phenyl-imidazol-3-ium CAS Name: 1-hydroxy-4-methyl-2-(4-nitrophenyl)-3-oxido-5-phenylimidazol-3-ium IUPAC Name: 1-hydroxy-4-methyl-2-(4-nitrophenyl)-3-oxido-5-phenylimidazol-3-ium Traditional Name: 1-hydroxy-4-methyl-2-(4-nitrophenyl)-3-oxido-5-phenyl-imidazol-3-ium Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=[N+]1[O-])C2=CC=C(C=C2)[N+](=O)[O-])O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(N(C(=[N+]1[O-])C2=CC=C(C=C2)[N+](=O)[O-])O)C3=CC=CC=C3

InChI

InChI=1S/C16H13N3O4/c1-11-15(12-5-3-2-4-6-12)18(21)16(17(11)20)13-7-9-14(10-8-13)19(22)23/h2-10,21H,1H3