methyl 2-[2-(4-chlorophenyl)sulfanylpropanoylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[2-(4-chlorophenyl)sulfanylpropanoylamino]-3-oxidanyl-propanoate Openeye Name: methyl 2-[2-(4-chlorophenyl)sulfanylpropanoylamino]-3-hydroxy-propanoate CAS Name: 2-[[2-[(4-chlorophenyl)thio]-1-oxopropyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[2-(4-chlorophenyl)sulfanylpropanoylamino]-3-hydroxypropanoate Traditional Name: 2-[2-[(4-chlorophenyl)thio]propanoylamino]-3-hydroxy-propionic acid methyl ester Formula: C13H16ClNO4S MolecularWeight: 317.78844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CO)C(=O)OC)SC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C(=O)NC(CO)C(=O)OC)SC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H16ClNO4S/c1-8(20-10-5-3-9(14)4-6-10)12(17)15-11(7-16)13(18)19-2/h3-6,8,11,16H,7H2,1-2H3,(H,15,17)