4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-2-(phenylmethyl)butanoic acid

Systemtic Name: 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-2-(phenylmethyl)butanoic acid Openeye Name: 2-benzyl-4-(5-chloro-2-thienyl)-4-oxo-butanoic acid CAS Name: 4-(5-chloro-2-thiophenyl)-4-oxo-2-(phenylmethyl)butanoic acid IUPAC Name: 2-benzyl-4-(5-chlorothiophen-2-yl)-4-oxobutanoic acid Traditional Name: 2-benzyl-4-(5-chloro-2-thienyl)-4-keto-butyric acid Formula: C15H13ClO3S MolecularWeight: 308.77992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(=O)C2=CC=C(S2)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CC(=O)C2=CC=C(S2)Cl)C(=O)O

InChI

InChI=1S/C15H13ClO3S/c16-14-7-6-13(20-14)12(17)9-11(15(18)19)8-10-4-2-1-3-5-10/h1-7,11H,8-9H2,(H,18,19)