4-(1,3-benzothiazol-6-yl)butanoic acid

Systemtic Name: 4-(1,3-benzothiazol-6-yl)butanoic acid Openeye Name: 4-(1,3-benzothiazol-6-yl)butanoic acid CAS Name: 4-(1,3-benzothiazol-6-yl)butanoic acid IUPAC Name: 4-(1,3-benzothiazol-6-yl)butanoic acid Traditional Name: 4-(1,3-benzothiazol-6-yl)butyric acid Formula: C11H11NO2S MolecularWeight: 221.27554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CCCC(=O)O)SC=N2

Isomeric SMILES

C1=CC2=C(C=C1CCCC(=O)O)SC=N2

InChI

InChI=1S/C11H11NO2S/c13-11(14)3-1-2-8-4-5-9-10(6-8)15-7-12-9/h4-7H,1-3H2,(H,13,14)