methyl (2S,3S)-2-azanyl-3-(3-chloranyl-4-phenylmethoxy-phenyl)-3-oxidanyl-propanoate

Systemtic Name: methyl (2S,3S)-2-azanyl-3-(3-chloranyl-4-phenylmethoxy-phenyl)-3-oxidanyl-propanoate Openeye Name: methyl (2S,3S)-2-amino-3-(4-benzyloxy-3-chloro-phenyl)-3-hydroxy-propanoate CAS Name: (2S,3S)-2-amino-3-(3-chloro-4-phenylmethoxyphenyl)-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl (2S,3S)-2-amino-3-(3-chloro-4-phenylmethoxyphenyl)-3-hydroxypropanoate Traditional Name: (2S,3S)-2-amino-3-(4-benzoxy-3-chloro-phenyl)-3-hydroxy-propionic acid methyl ester Formula: C17H18ClNO4 MolecularWeight: 335.78212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C1=CC(=C(C=C1)OCC2=CC=CC=C2)Cl)O)N

Isomeric SMILES

COC(=O)[C@H]([C@H](C1=CC(=C(C=C1)OCC2=CC=CC=C2)Cl)O)N

InChI

InChI=1S/C17H18ClNO4/c1-22-17(21)15(19)16(20)12-7-8-14(13(18)9-12)23-10-11-5-3-2-4-6-11/h2-9,15-16,20H,10,19H2,1H3/t15-,16-/m0/s1