ethyl (2S,3R)-2,3-bis(chloranyl)-3-(4-methylphenyl)propanoate

Systemtic Name: ethyl (2S,3R)-2,3-bis(chloranyl)-3-(4-methylphenyl)propanoate Openeye Name: ethyl (2S,3R)-2,3-dichloro-3-(p-tolyl)propanoate CAS Name: (2S,3R)-2,3-dichloro-3-(4-methylphenyl)propanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-2,3-dichloro-3-(4-methylphenyl)propanoate Traditional Name: (2S,3R)-2,3-dichloro-3-(p-tolyl)propionic acid ethyl ester Formula: C12H14Cl2O2 MolecularWeight: 261.14436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)C)Cl)Cl

Isomeric SMILES

CCOC(=O)[C@@H]([C@@H](C1=CC=C(C=C1)C)Cl)Cl

InChI

InChI=1S/C12H14Cl2O2/c1-3-16-12(15)11(14)10(13)9-6-4-8(2)5-7-9/h4-7,10-11H,3H2,1-2H3/t10-,11-/m1/s1