methyl 3-[1-[(3-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[1-[(3-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylpropanoate Openeye Name: methyl 3-[2-(3-chloroanilino)-1-methyl-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[1-(3-chloroanilino)-1-oxopropan-2-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[1-(3-chloroanilino)-1-oxopropan-2-yl]sulfanylpropanoate Traditional Name: 3-[[2-(3-chloroanilino)-2-keto-1-methyl-ethyl]thio]propionic acid methyl ester Formula: C13H16ClNO3S MolecularWeight: 301.78904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)Cl)SCCC(=O)OC

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)Cl)SCCC(=O)OC

InChI

InChI=1S/C13H16ClNO3S/c1-9(19-7-6-12(16)18-2)13(17)15-11-5-3-4-10(14)8-11/h3-5,8-9H,6-7H2,1-2H3,(H,15,17)