methyl 4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxylate; sulfuric acid

Systemtic Name: methyl 4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxylate; sulfuric acid Openeye Name: methyl 4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxylate; sulfuric acid CAS Name: sulfuric acid; 4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxylate; sulfuric acid Traditional Name: sulfuric acid; 4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxylic acid methyl ester Formula: C9H14N2O6S MolecularWeight: 278.28226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC2=C(C1)NC=N2.OS(=O)(=O)O

Isomeric SMILES

COC(=O)C1CCC2=C(C1)NC=N2.OS(=O)(=O)O

InChI

InChI=1S/C9H12N2O2.H2O4S/c1-13-9(12)6-2-3-7-8(4-6)11-5-10-7;1-5(2,3)4/h5-6H,2-4H2,1H3,(H,10,11);(H2,1,2,3,4)