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

Systemtic Name: 2-(5-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)propanoic acid Openeye Name: 2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)propanoic acid CAS Name: 2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)propanoic acid IUPAC Name: 2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)propanoic acid Traditional Name: 2-(5-chloro-2-keto-1,3-benzothiazol-3-yl)propionic acid Formula: C10H8ClNO3S MolecularWeight: 257.69342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C2=C(C=CC(=C2)Cl)SC1=O

Isomeric SMILES

CC(C(=O)O)N1C2=C(C=CC(=C2)Cl)SC1=O

InChI

InChI=1S/C10H8ClNO3S/c1-5(9(13)14)12-7-4-6(11)2-3-8(7)16-10(12)15/h2-5H,1H3,(H,13,14)