2-(1,3-benzothiazol-5-yl)propanoic acid

Systemtic Name: 2-(1,3-benzothiazol-5-yl)propanoic acid Openeye Name: 2-(1,3-benzothiazol-5-yl)propanoic acid CAS Name: 2-(1,3-benzothiazol-5-yl)propanoic acid IUPAC Name: 2-(1,3-benzothiazol-5-yl)propanoic acid Traditional Name: 2-(1,3-benzothiazol-5-yl)propionic acid Formula: C10H9NO2S MolecularWeight: 207.24896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)SC=N2)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)SC=N2)C(=O)O

InChI

InChI=1S/C10H9NO2S/c1-6(10(12)13)7-2-3-9-8(4-7)11-5-14-9/h2-6H,1H3,(H,12,13)