1,3-benzothiazole-5-sulfonic acid

Systemtic Name: 1,3-benzothiazole-5-sulfonic acid Openeye Name: 1,3-benzothiazole-5-sulfonic acid CAS Name: 1,3-benzothiazole-5-sulfonic acid IUPAC Name: 1,3-benzothiazole-5-sulfonic acid Traditional Name: 1,3-benzothiazole-5-sulfonic acid Formula: C7H5NO3S2 MolecularWeight: 215.2495

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)O)N=CS2

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)O)N=CS2

InChI

InChI=1S/C7H5NO3S2/c9-13(10,11)5-1-2-7-6(3-5)8-4-12-7/h1-4H,(H,9,10,11)