6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazole-5-sulfonate

Systemtic Name: 6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazole-5-sulfonate Openeye Name: 6-methyl-2-oxo-1,3-dihydrobenzimidazole-5-sulfonate CAS Name: 6-methyl-2-oxo-1,3-dihydrobenzimidazole-5-sulfonate IUPAC Name: 6-methyl-2-oxo-1,3-dihydrobenzimidazole-5-sulfonate Traditional Name: 2-keto-6-methyl-1,3-dihydrobenzimidazole-5-sulfonate Formula: C8H7N2O4S- MolecularWeight: 227.21718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)[O-])NC(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)[O-])NC(=O)N2

InChI

InChI=1S/C8H8N2O4S/c1-4-2-5-6(10-8(11)9-5)3-7(4)15(12,13)14/h2-3H,1H3,(H2,9,10,11)(H,12,13,14)/p-1