2-(1,2-benzothiazol-3-yl)ethanoic acid

Systemtic Name: 2-(1,2-benzothiazol-3-yl)ethanoic acid Openeye Name: 2-(1,2-benzothiazol-3-yl)acetic acid CAS Name: 2-(1,2-benzothiazol-3-yl)acetic acid IUPAC Name: 2-(1,2-benzothiazol-3-yl)acetic acid Traditional Name: 2-(1,2-benzothiazol-3-yl)acetic acid Formula: C9H7NO2S MolecularWeight: 193.22238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2)CC(=O)O

InChI

InChI=1S/C9H7NO2S/c11-9(12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H,11,12)