1,3-benzothiazole-4-carboxylic acid

Systemtic Name: 1,3-benzothiazole-4-carboxylic acid Openeye Name: 1,3-benzothiazole-4-carboxylic acid CAS Name: 1,3-benzothiazole-4-carboxylic acid IUPAC Name: 1,3-benzothiazole-4-carboxylic acid Traditional Name: 1,3-benzothiazole-4-carboxylic acid Formula: C8H5NO2S MolecularWeight: 179.1958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)SC=N2)C(=O)O

Isomeric SMILES

C1=CC(=C2C(=C1)SC=N2)C(=O)O

InChI

InChI=1S/C8H5NO2S/c10-8(11)5-2-1-3-6-7(5)9-4-12-6/h1-4H,(H,10,11)