2-chloranyl-6-(1-phenylsulfanylethyl)benzoic acid

Systemtic Name: 2-chloranyl-6-(1-phenylsulfanylethyl)benzoic acid Openeye Name: 2-chloro-6-(1-phenylsulfanylethyl)benzoic acid CAS Name: 2-chloro-6-[1-(phenylthio)ethyl]benzoic acid IUPAC Name: 2-chloro-6-(1-phenylsulfanylethyl)benzoic acid Traditional Name: 2-chloro-6-[1-(phenylthio)ethyl]benzoic acid Formula: C15H13ClO2S MolecularWeight: 292.78052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13ClO2S/c1-10(19-11-6-3-2-4-7-11)12-8-5-9-13(16)14(12)15(17)18/h2-10H,1H3,(H,17,18)