3-(7-chloranyl-1,3-benzothiazol-2-yl)propanoic acid

Systemtic Name: 3-(7-chloranyl-1,3-benzothiazol-2-yl)propanoic acid Openeye Name: 3-(7-chloro-1,3-benzothiazol-2-yl)propanoic acid CAS Name: 3-(7-chloro-1,3-benzothiazol-2-yl)propanoic acid IUPAC Name: 3-(7-chloro-1,3-benzothiazol-2-yl)propanoic acid Traditional Name: 3-(7-chloro-1,3-benzothiazol-2-yl)propionic acid Formula: C10H8ClNO2S MolecularWeight: 241.69402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)SC(=N2)CCC(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)SC(=N2)CCC(=O)O

InChI

InChI=1S/C10H8ClNO2S/c11-6-2-1-3-7-10(6)15-8(12-7)4-5-9(13)14/h1-3H,4-5H2,(H,13,14)