2-(1,3-benzothiazol-4-yl)ethanoic acid

Systemtic Name: 2-(1,3-benzothiazol-4-yl)ethanoic acid Openeye Name: 2-(1,3-benzothiazol-4-yl)acetic acid CAS Name: 2-(1,3-benzothiazol-4-yl)acetic acid IUPAC Name: 2-(1,3-benzothiazol-4-yl)acetic acid Traditional Name: 2-(1,3-benzothiazol-4-yl)acetic acid Formula: C9H7NO2S MolecularWeight: 193.22238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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