[(3S)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl] 2-(2-chloranylphenoxy)ethanoate

Systemtic Name: [(3S)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl] 2-(2-chloranylphenoxy)ethanoate Openeye Name: [(3S)-3-cyano-3-(4-methylthiazol-2-yl)-2-oxo-propyl] 2-(2-chlorophenoxy)acetate CAS Name: 2-(2-chlorophenoxy)acetic acid [(3S)-3-cyano-3-(4-methyl-2-thiazolyl)-2-oxopropyl] ester IUPAC Name: [(3S)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxopropyl] 2-(2-chlorophenoxy)acetate Traditional Name: 2-(2-chlorophenoxy)acetic acid [(3S)-3-cyano-2-keto-3-(4-methylthiazol-2-yl)propyl] ester Formula: C16H13ClN2O4S MolecularWeight: 364.80342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)COC(=O)COC2=CC=CC=C2Cl

Isomeric SMILES

CC1=CSC(=N1)[C@@H](C#N)C(=O)COC(=O)COC2=CC=CC=C2Cl

InChI

InChI=1S/C16H13ClN2O4S/c1-10-9-24-16(19-10)11(6-18)13(20)7-23-15(21)8-22-14-5-3-2-4-12(14)17/h2-5,9,11H,7-8H2,1H3/t11-/m0/s1