4,4-dimethyl-2-(4-nitrophenyl)-1-oxidanidyl-3-oxidanyl-5-phenyl-2H-imidazol-1-ium

Systemtic Name: 4,4-dimethyl-2-(4-nitrophenyl)-1-oxidanidyl-3-oxidanyl-5-phenyl-2H-imidazol-1-ium Openeye Name: 3-hydroxy-4,4-dimethyl-2-(4-nitrophenyl)-1-oxido-5-phenyl-2H-imidazol-1-ium CAS Name: 3-hydroxy-4,4-dimethyl-2-(4-nitrophenyl)-1-oxido-5-phenyl-2H-imidazol-1-ium IUPAC Name: 3-hydroxy-4,4-dimethyl-2-(4-nitrophenyl)-1-oxido-5-phenyl-2H-imidazol-1-ium Traditional Name: 3-hydroxy-4,4-dimethyl-2-(4-nitrophenyl)-1-oxido-5-phenyl-3-imidazolin-1-ium Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=[N+](C(N1O)C2=CC=C(C=C2)[N+](=O)[O-])[O-])C3=CC=CC=C3)C

Isomeric SMILES

CC1(C(=[N+](C(N1O)C2=CC=C(C=C2)[N+](=O)[O-])[O-])C3=CC=CC=C3)C

InChI

InChI=1S/C17H17N3O4/c1-17(2)15(12-6-4-3-5-7-12)18(21)16(19(17)22)13-8-10-14(11-9-13)20(23)24/h3-11,16,22H,1-2H3