2-(5-chloranyl-4-ethyl-2-oxidanylidene-1,3-benzothiazol-3-yl)propanoic acid

Systemtic Name: 2-(5-chloranyl-4-ethyl-2-oxidanylidene-1,3-benzothiazol-3-yl)propanoic acid Openeye Name: 2-(5-chloro-4-ethyl-2-oxo-1,3-benzothiazol-3-yl)propanoic acid CAS Name: 2-(5-chloro-4-ethyl-2-oxo-1,3-benzothiazol-3-yl)propanoic acid IUPAC Name: 2-(5-chloro-4-ethyl-2-oxo-1,3-benzothiazol-3-yl)propanoic acid Traditional Name: 2-(5-chloro-4-ethyl-2-keto-1,3-benzothiazol-3-yl)propionic acid Formula: C12H12ClNO3S MolecularWeight: 285.74658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC2=C1N(C(=O)S2)C(C)C(=O)O)Cl

Isomeric SMILES

CCC1=C(C=CC2=C1N(C(=O)S2)C(C)C(=O)O)Cl

InChI

InChI=1S/C12H12ClNO3S/c1-3-7-8(13)4-5-9-10(7)14(12(17)18-9)6(2)11(15)16/h4-6H,3H2,1-2H3,(H,15,16)