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

Systemtic Name: ethyl (3S)-1-[(2R)-3-(2-ethanoylphenoxy)-2-oxidanyl-propyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[(2R)-3-(2-acetylphenoxy)-2-hydroxy-propyl]piperidine-3-carboxylate CAS Name: (3S)-1-[(2R)-3-(2-acetylphenoxy)-2-hydroxypropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[(2R)-3-(2-acetylphenoxy)-2-hydroxypropyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[(2R)-3-(2-acetylphenoxy)-2-hydroxy-propyl]nipecotic acid ethyl ester Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(COC2=CC=CC=C2C(=O)C)O

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C[C@H](COC2=CC=CC=C2C(=O)C)O

InChI

InChI=1S/C19H27NO5/c1-3-24-19(23)15-7-6-10-20(11-15)12-16(22)13-25-18-9-5-4-8-17(18)14(2)21/h4-5,8-9,15-16,22H,3,6-7,10-13H2,1-2H3/t15-,16+/m0/s1