methyl 3-[(2R)-1-[(2,4-dichlorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylpropanoate

Systemtic Name: methyl 3-[(2R)-1-[(2,4-dichlorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylpropanoate Openeye Name: methyl 3-[(1R)-2-(2,4-dichloroanilino)-1-methyl-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[(2R)-1-(2,4-dichloroanilino)-1-oxopropan-2-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(2R)-1-(2,4-dichloroanilino)-1-oxopropan-2-yl]sulfanylpropanoate Traditional Name: 3-[[(1R)-2-(2,4-dichloroanilino)-2-keto-1-methyl-ethyl]thio]propionic acid methyl ester Formula: C13H15Cl2NO3S MolecularWeight: 336.2341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)Cl)Cl)SCCC(=O)OC

InChI

InChI=1S/C13H15Cl2NO3S/c1-8(20-6-5-12(17)19-2)13(18)16-11-4-3-9(14)7-10(11)15/h3-4,7-8H,5-6H2,1-2H3,(H,16,18)/t8-/m1/s1