2-(methoxycarbonylamino)-3H-benzimidazole-5-sulfonic acid

Systemtic Name: 2-(methoxycarbonylamino)-3H-benzimidazole-5-sulfonic acid Openeye Name: 2-(methoxycarbonylamino)-3H-benzimidazole-5-sulfonic acid CAS Name: 2-(methoxycarbonylamino)-3H-benzimidazole-5-sulfonic acid IUPAC Name: 2-(methoxycarbonylamino)-3H-benzimidazole-5-sulfonic acid Traditional Name: 2-(carbomethoxyamino)-3H-benzimidazole-5-sulfonic acid Formula: C9H9N3O5S MolecularWeight: 271.24986

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)O

Isomeric SMILES

COC(=O)NC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C9H9N3O5S/c1-17-9(13)12-8-10-6-3-2-5(18(14,15)16)4-7(6)11-8/h2-4H,1H3,(H,14,15,16)(H2,10,11,12,13)