methyl 3H-benzimidazole-5-carboxylate; sulfuric acid

Systemtic Name: methyl 3H-benzimidazole-5-carboxylate; sulfuric acid Openeye Name: methyl 3H-benzimidazole-5-carboxylate; sulfuric acid CAS Name: 3H-benzimidazole-5-carboxylic acid methyl ester; sulfuric acid IUPAC Name: methyl 3H-benzimidazole-5-carboxylate; sulfuric acid Traditional Name: 3H-benzimidazole-5-carboxylic acid methyl ester; sulfuric acid Formula: C9H10N2O6S MolecularWeight: 274.2505

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=CN2.OS(=O)(=O)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=CN2.OS(=O)(=O)O

InChI

InChI=1S/C9H8N2O2.H2O4S/c1-13-9(12)6-2-3-7-8(4-6)11-5-10-7;1-5(2,3)4/h2-5H,1H3,(H,10,11);(H2,1,2,3,4)