ethyl (3S,5R)-3-(1-chloranyl-4-oxidanyl-butyl)-2-phenyl-1,2-oxazolidine-5-carboxylate

Systemtic Name: ethyl (3S,5R)-3-(1-chloranyl-4-oxidanyl-butyl)-2-phenyl-1,2-oxazolidine-5-carboxylate Openeye Name: ethyl (3S,5R)-3-(1-chloro-4-hydroxy-butyl)-2-phenyl-isoxazolidine-5-carboxylate CAS Name: (3S,5R)-3-(1-chloro-4-hydroxybutyl)-2-phenyl-5-isoxazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S,5R)-3-(1-chloro-4-hydroxybutyl)-2-phenyl-1,2-oxazolidine-5-carboxylate Traditional Name: (3S,5R)-3-(1-chloro-4-hydroxy-butyl)-2-phenyl-isoxazolidine-5-carboxylic acid ethyl ester Formula: C16H22ClNO4 MolecularWeight: 327.80318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(N(O1)C2=CC=CC=C2)C(CCCO)Cl

Isomeric SMILES

CCOC(=O)[C@H]1C[C@H](N(O1)C2=CC=CC=C2)C(CCCO)Cl

InChI

InChI=1S/C16H22ClNO4/c1-2-21-16(20)15-11-14(13(17)9-6-10-19)18(22-15)12-7-4-3-5-8-12/h3-5,7-8,13-15,19H,2,6,9-11H2,1H3/t13?,14-,15+/m0/s1