N,N-dimethyl-4-[(2-methyl-3-nitro-phenyl)-oxidanyl-methyl]imidazole-1-sulfonamide

Systemtic Name: N,N-dimethyl-4-[(2-methyl-3-nitro-phenyl)-oxidanyl-methyl]imidazole-1-sulfonamide Openeye Name: 4-[hydroxy-(2-methyl-3-nitro-phenyl)methyl]-N,N-dimethyl-imidazole-1-sulfonamide CAS Name: 4-[hydroxy-(2-methyl-3-nitrophenyl)methyl]-N,N-dimethyl-1-imidazolesulfonamide IUPAC Name: 4-[hydroxy-(2-methyl-3-nitrophenyl)methyl]-N,N-dimethylimidazole-1-sulfonamide Traditional Name: 4-[hydroxy-(2-methyl-3-nitro-phenyl)methyl]-N,N-dimethyl-imidazole-1-sulfonamide Formula: C13H16N4O5S MolecularWeight: 340.35494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(C2=CN(C=N2)S(=O)(=O)N(C)C)O

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(C2=CN(C=N2)S(=O)(=O)N(C)C)O

InChI

InChI=1S/C13H16N4O5S/c1-9-10(5-4-6-12(9)17(19)20)13(18)11-7-16(8-14-11)23(21,22)15(2)3/h4-8,13,18H,1-3H3