3-[4-(3-chlorophenyl)-5-methyl-2-oxidanylidene-1,3-thiazol-3-yl]propanoic acid

Systemtic Name: 3-[4-(3-chlorophenyl)-5-methyl-2-oxidanylidene-1,3-thiazol-3-yl]propanoic acid Openeye Name: 3-[4-(3-chlorophenyl)-5-methyl-2-oxo-thiazol-3-yl]propanoic acid CAS Name: 3-[4-(3-chlorophenyl)-5-methyl-2-oxo-3-thiazolyl]propanoic acid IUPAC Name: 3-[4-(3-chlorophenyl)-5-methyl-2-oxo-1,3-thiazol-3-yl]propanoic acid Traditional Name: 3-[4-(3-chlorophenyl)-2-keto-5-methyl-4-thiazolin-3-yl]propionic acid Formula: C13H12ClNO3S MolecularWeight: 297.75728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=O)S1)CCC(=O)O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=C(N(C(=O)S1)CCC(=O)O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H12ClNO3S/c1-8-12(9-3-2-4-10(14)7-9)15(13(18)19-8)6-5-11(16)17/h2-4,7H,5-6H2,1H3,(H,16,17)