3-(3-chlorophenyl)-2-ethanoyl-4-oxidanylidene-4-thiophen-2-yl-butanoic acid

Systemtic Name: 3-(3-chlorophenyl)-2-ethanoyl-4-oxidanylidene-4-thiophen-2-yl-butanoic acid Openeye Name: 2-acetyl-3-(3-chlorophenyl)-4-oxo-4-(2-thienyl)butanoic acid CAS Name: 2-acetyl-3-(3-chlorophenyl)-4-oxo-4-thiophen-2-ylbutanoic acid IUPAC Name: 2-acetyl-3-(3-chlorophenyl)-4-oxo-4-thiophen-2-ylbutanoic acid Traditional Name: 2-acetyl-3-(3-chlorophenyl)-4-keto-4-(2-thienyl)butyric acid Formula: C16H13ClO4S MolecularWeight: 336.79002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C1=CC(=CC=C1)Cl)C(=O)C2=CC=CS2)C(=O)O

Isomeric SMILES

CC(=O)C(C(C1=CC(=CC=C1)Cl)C(=O)C2=CC=CS2)C(=O)O

InChI

InChI=1S/C16H13ClO4S/c1-9(18)13(16(20)21)14(10-4-2-5-11(17)8-10)15(19)12-6-3-7-22-12/h2-8,13-14H,1H3,(H,20,21)