methyl 2-(3-chlorophenyl)-2-ethanoylsulfanyl-ethanoate

Systemtic Name: methyl 2-(3-chlorophenyl)-2-ethanoylsulfanyl-ethanoate Openeye Name: methyl 2-acetylsulfanyl-2-(3-chlorophenyl)acetate CAS Name: 2-(acetylthio)-2-(3-chlorophenyl)acetic acid methyl ester IUPAC Name: methyl 2-acetylsulfanyl-2-(3-chlorophenyl)acetate Traditional Name: 2-(acetylthio)-2-(3-chlorophenyl)acetic acid methyl ester Formula: C11H11ClO3S MolecularWeight: 258.72124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11ClO3S/c1-7(13)16-10(11(14)15-2)8-4-3-5-9(12)6-8/h3-6,10H,1-2H3