6-aminocarbonyl-1-oxidanyl-benzotriazol-1-ium-1-sulfonic acid

Systemtic Name: 6-aminocarbonyl-1-oxidanyl-benzotriazol-1-ium-1-sulfonic acid Openeye Name: 6-carbamoyl-1-hydroxy-benzotriazol-1-ium-1-sulfonic acid CAS Name: 6-carbamoyl-1-hydroxy-1-benzotriazol-1-iumsulfonic acid IUPAC Name: 6-carbamoyl-1-hydroxybenzotriazol-1-ium-1-sulfonic acid Traditional Name: 6-carbamoyl-1-hydroxy-benzotriazol-1-ium-1-sulfonic acid Formula: C7H7N4O5S+ MolecularWeight: 259.21928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)N)[N+](N=N2)(O)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(=O)N)[N+](N=N2)(O)S(=O)(=O)O

InChI

InChI=1S/C7H6N4O5S/c8-7(12)4-1-2-5-6(3-4)11(13,10-9-5)17(14,15)16/h1-3,13H,(H2-,8,12,14,15,16)/p+1