4-chloranyl-2-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethyl)sulfanyl-benzoic acid

Systemtic Name: 4-chloranyl-2-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethyl)sulfanyl-benzoic acid Openeye Name: 4-chloro-2-(2-hydroxy-2-oxo-1-phenyl-ethyl)sulfanyl-benzoic acid CAS Name: 4-chloro-2-[(2-hydroxy-2-oxo-1-phenylethyl)thio]benzoic acid IUPAC Name: 4-chloro-2-(2-hydroxy-2-oxo-1-phenylethyl)sulfanylbenzoic acid Traditional Name: 4-chloro-2-[(2-hydroxy-2-keto-1-phenyl-ethyl)thio]benzoic acid Formula: C15H11ClO4S MolecularWeight: 322.76344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)SC2=C(C=CC(=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)O)SC2=C(C=CC(=C2)Cl)C(=O)O

InChI

InChI=1S/C15H11ClO4S/c16-10-6-7-11(14(17)18)12(8-10)21-13(15(19)20)9-4-2-1-3-5-9/h1-8,13H,(H,17,18)(H,19,20)