4-(2-sulfoethylcarbamoyl)-1H-imidazole-5-carboxylic acid

Systemtic Name: 4-(2-sulfoethylcarbamoyl)-1H-imidazole-5-carboxylic acid Openeye Name: 4-(2-sulfoethylcarbamoyl)-1H-imidazole-5-carboxylic acid CAS Name: 4-[oxo-(2-sulfoethylamino)methyl]-1H-imidazole-5-carboxylic acid IUPAC Name: 4-(2-sulfoethylcarbamoyl)-1H-imidazole-5-carboxylic acid Traditional Name: 4-(2-sulfoethylcarbamoyl)-1H-imidazole-5-carboxylic acid Formula: C7H9N3O6S MolecularWeight: 263.22786

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C(N1)C(=O)O)C(=O)NCCS(=O)(=O)O

Isomeric SMILES

C1=NC(=C(N1)C(=O)O)C(=O)NCCS(=O)(=O)O

InChI

InChI=1S/C7H9N3O6S/c11-6(8-1-2-17(14,15)16)4-5(7(12)13)10-3-9-4/h3H,1-2H2,(H,8,11)(H,9,10)(H,12,13)(H,14,15,16)