methyl 3-methylbenzimidazole-5-carboxylate sulfate

Systemtic Name: methyl 3-methylbenzimidazole-5-carboxylate sulfate Openeye Name: methyl 3-methylbenzimidazole-5-carboxylate sulfate CAS Name: 3-methyl-5-benzimidazolecarboxylic acid methyl ester sulfate IUPAC Name: methyl 3-methylbenzimidazole-5-carboxylate sulfate Traditional Name: 3-methylbenzimidazole-5-carboxylic acid methyl ester sulfate Formula: C10H10N2O6S-2 MolecularWeight: 286.2612

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C=C(C=C2)C(=O)OC.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CN1C=NC2=C1C=C(C=C2)C(=O)OC.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C10H10N2O2.H2O4S/c1-12-6-11-8-4-3-7(5-9(8)12)10(13)14-2;1-5(2,3)4/h3-6H,1-2H3;(H2,1,2,3,4)/p-2