ethyl (2R,3R)-2-azanyl-3-(3-chloranyl-4-phenylmethoxy-phenyl)-3-oxidanyl-propanoate

Systemtic Name: ethyl (2R,3R)-2-azanyl-3-(3-chloranyl-4-phenylmethoxy-phenyl)-3-oxidanyl-propanoate Openeye Name: ethyl (2R,3R)-2-amino-3-(4-benzyloxy-3-chloro-phenyl)-3-hydroxy-propanoate CAS Name: (2R,3R)-2-amino-3-(3-chloro-4-phenylmethoxyphenyl)-3-hydroxypropanoic acid ethyl ester IUPAC Name: ethyl (2R,3R)-2-amino-3-(3-chloro-4-phenylmethoxyphenyl)-3-hydroxypropanoate Traditional Name: (2R,3R)-2-amino-3-(4-benzoxy-3-chloro-phenyl)-3-hydroxy-propionic acid ethyl ester Formula: C18H20ClNO4 MolecularWeight: 349.8087

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClNO4/c1-2-23-18(22)16(20)17(21)13-8-9-15(14(19)10-13)24-11-12-6-4-3-5-7-12/h3-10,16-17,21H,2,11,20H2,1H3/t16-,17-/m1/s1