2-(5-chloranyl-1,2-benzothiazol-3-yl)ethanoic acid

Systemtic Name: 2-(5-chloranyl-1,2-benzothiazol-3-yl)ethanoic acid Openeye Name: 2-(5-chloro-1,2-benzothiazol-3-yl)acetic acid CAS Name: 2-(5-chloro-1,2-benzothiazol-3-yl)acetic acid IUPAC Name: 2-(5-chloro-1,2-benzothiazol-3-yl)acetic acid Traditional Name: 2-(5-chloro-1,2-benzothiazol-3-yl)acetic acid Formula: C9H6ClNO2S MolecularWeight: 227.66744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=NS2)CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=NS2)CC(=O)O

InChI

InChI=1S/C9H6ClNO2S/c10-5-1-2-8-6(3-5)7(11-14-8)4-9(12)13/h1-3H,4H2,(H,12,13)