5-ethoxy-1-methyl-benzimidazole-2-sulfonic acid

Systemtic Name: 5-ethoxy-1-methyl-benzimidazole-2-sulfonic acid Openeye Name: 5-ethoxy-1-methyl-benzimidazole-2-sulfonic acid CAS Name: 5-ethoxy-1-methyl-2-benzimidazolesulfonic acid IUPAC Name: 5-ethoxy-1-methylbenzimidazole-2-sulfonic acid Traditional Name: 5-ethoxy-1-methyl-benzimidazole-2-sulfonic acid Formula: C10H12N2O4S MolecularWeight: 256.27828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=N2)S(=O)(=O)O)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=N2)S(=O)(=O)O)C

InChI

InChI=1S/C10H12N2O4S/c1-3-16-7-4-5-9-8(6-7)11-10(12(9)2)17(13,14)15/h4-6H,3H2,1-2H3,(H,13,14,15)