ethyl (2S,3S)-3-chloranyl-2-oxidanyl-4-phenyl-butanoate

Systemtic Name: ethyl (2S,3S)-3-chloranyl-2-oxidanyl-4-phenyl-butanoate Openeye Name: ethyl (2S,3S)-3-chloro-2-hydroxy-4-phenyl-butanoate CAS Name: (2S,3S)-3-chloro-2-hydroxy-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl (2S,3S)-3-chloro-2-hydroxy-4-phenylbutanoate Traditional Name: (2S,3S)-3-chloro-2-hydroxy-4-phenyl-butyric acid ethyl ester Formula: C12H15ClO3 MolecularWeight: 242.6987

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CC1=CC=CC=C1)Cl)O

Isomeric SMILES

CCOC(=O)[C@@H]([C@H](CC1=CC=CC=C1)Cl)O

InChI

InChI=1S/C12H15ClO3/c1-2-16-12(15)11(14)10(13)8-9-6-4-3-5-7-9/h3-7,10-11,14H,2,8H2,1H3/t10-,11+/m0/s1