2-(3-oxidanidyl-2H-1,3-benzothiazol-3-ium-3-yl)ethanoic acid

Systemtic Name: 2-(3-oxidanidyl-2H-1,3-benzothiazol-3-ium-3-yl)ethanoic acid Openeye Name: 2-(3-oxido-2H-1,3-benzothiazol-3-ium-3-yl)acetic acid CAS Name: 2-(3-oxido-2H-1,3-benzothiazol-3-ium-3-yl)acetic acid IUPAC Name: 2-(3-oxido-2H-1,3-benzothiazol-3-ium-3-yl)acetic acid Traditional Name: 2-(3-oxido-2H-1,3-benzothiazol-3-ium-3-yl)acetic acid Formula: C9H9NO3S MolecularWeight: 211.23766

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Descriptors Computed from Structure

Canonical SMILES:

C1[N+](C2=CC=CC=C2S1)(CC(=O)O)[O-]

Isomeric SMILES

C1[N+](C2=CC=CC=C2S1)(CC(=O)O)[O-]

InChI

InChI=1S/C9H9NO3S/c11-9(12)5-10(13)6-14-8-4-2-1-3-7(8)10/h1-4H,5-6H2,(H,11,12)