2-acetyloxy-2-(3-chloranyl-4-methylsulfanyl-phenyl)ethanoic acid

Systemtic Name: 2-acetyloxy-2-(3-chloranyl-4-methylsulfanyl-phenyl)ethanoic acid Openeye Name: 2-acetoxy-2-(3-chloro-4-methylsulfanyl-phenyl)acetic acid CAS Name: 2-acetyloxy-2-[3-chloro-4-(methylthio)phenyl]acetic acid IUPAC Name: 2-acetyloxy-2-(3-chloro-4-methylsulfanylphenyl)acetic acid Traditional Name: 2-acetoxy-2-[3-chloro-4-(methylthio)phenyl]acetic acid Formula: C11H11ClO4S MolecularWeight: 274.72064

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC(=C(C=C1)SC)Cl)C(=O)O

Isomeric SMILES

CC(=O)OC(C1=CC(=C(C=C1)SC)Cl)C(=O)O

InChI

InChI=1S/C11H11ClO4S/c1-6(13)16-10(11(14)15)7-3-4-9(17-2)8(12)5-7/h3-5,10H,1-2H3,(H,14,15)