2,2,4,4-tetramethyl-5-(4-nitrophenyl)-1-oxidanidyl-3-oxidanyl-imidazol-1-ium

Systemtic Name: 2,2,4,4-tetramethyl-5-(4-nitrophenyl)-1-oxidanidyl-3-oxidanyl-imidazol-1-ium Openeye Name: 3-hydroxy-2,2,4,4-tetramethyl-5-(4-nitrophenyl)-1-oxido-imidazol-1-ium CAS Name: 3-hydroxy-2,2,4,4-tetramethyl-5-(4-nitrophenyl)-1-oxidoimidazol-1-ium IUPAC Name: 3-hydroxy-2,2,4,4-tetramethyl-5-(4-nitrophenyl)-1-oxidoimidazol-1-ium Traditional Name: 3-hydroxy-2,2,4,4-tetramethyl-5-(4-nitrophenyl)-1-oxido-3-imidazolin-1-ium Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O4/c1-12(2)11(14(17)13(3,4)16(12)20)9-5-7-10(8-6-9)15(18)19/h5-8,20H,1-4H3