ethyl (3S)-1-[(2R)-3-(2-chloranylphenoxy)-2-oxidanyl-propyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[(2R)-3-(2-chloranylphenoxy)-2-oxidanyl-propyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[(2R)-3-(2-chlorophenoxy)-2-hydroxy-propyl]piperidine-3-carboxylate CAS Name: (3S)-1-[(2R)-3-(2-chlorophenoxy)-2-hydroxypropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[(2R)-3-(2-chlorophenoxy)-2-hydroxypropyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[(2R)-3-(2-chlorophenoxy)-2-hydroxy-propyl]nipecotic acid ethyl ester Formula: C17H24ClNO4 MolecularWeight: 341.82976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(COC2=CC=CC=C2Cl)O

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C[C@H](COC2=CC=CC=C2Cl)O

InChI

InChI=1S/C17H24ClNO4/c1-2-22-17(21)13-6-5-9-19(10-13)11-14(20)12-23-16-8-4-3-7-15(16)18/h3-4,7-8,13-14,20H,2,5-6,9-12H2,1H3/t13-,14+/m0/s1