3-oxidanidyl-1,3-benzothiazol-3-ium-2-carboxylic acid

Systemtic Name: 3-oxidanidyl-1,3-benzothiazol-3-ium-2-carboxylic acid Openeye Name: 3-oxido-1,3-benzothiazol-3-ium-2-carboxylic acid CAS Name: 3-oxido-1,3-benzothiazol-3-ium-2-carboxylic acid IUPAC Name: 3-oxido-1,3-benzothiazol-3-ium-2-carboxylic acid Traditional Name: 3-oxido-1,3-benzothiazol-3-ium-2-carboxylic acid Formula: C8H5NO3S MolecularWeight: 195.1952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[N+](=C(S2)C(=O)O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)[N+](=C(S2)C(=O)O)[O-]

InChI

InChI=1S/C8H5NO3S/c10-8(11)7-9(12)5-3-1-2-4-6(5)13-7/h1-4H,(H,10,11)