phenyl 1-methyl-5-nitro-imidazole-4-sulfonate

Systemtic Name: phenyl 1-methyl-5-nitro-imidazole-4-sulfonate Openeye Name: phenyl 1-methyl-5-nitro-imidazole-4-sulfonate CAS Name: 1-methyl-5-nitro-4-imidazolesulfonic acid phenyl ester IUPAC Name: phenyl 1-methyl-5-nitroimidazole-4-sulfonate Traditional Name: 1-methyl-5-nitro-imidazole-4-sulfonic acid phenyl ester Formula: C10H9N3O5S MolecularWeight: 283.26056

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1[N+](=O)[O-])S(=O)(=O)OC2=CC=CC=C2

Isomeric SMILES

CN1C=NC(=C1[N+](=O)[O-])S(=O)(=O)OC2=CC=CC=C2

InChI

InChI=1S/C10H9N3O5S/c1-12-7-11-9(10(12)13(14)15)19(16,17)18-8-5-3-2-4-6-8/h2-7H,1H3