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

Systemtic Name: ethyl (3S)-1-[(2R)-2-oxidanyl-3-(2-propan-2-ylphenoxy)propyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[(2R)-2-hydroxy-3-(2-isopropylphenoxy)propyl]piperidine-3-carboxylate CAS Name: (3S)-1-[(2R)-2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[(2R)-2-hydroxy-3-(2-propan-2-ylphenoxy)propyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[(2R)-2-hydroxy-3-(2-isopropylphenoxy)propyl]nipecotic acid ethyl ester Formula: C20H31NO4 MolecularWeight: 349.46444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31NO4/c1-4-24-20(23)16-8-7-11-21(12-16)13-17(22)14-25-19-10-6-5-9-18(19)15(2)3/h5-6,9-10,15-17,22H,4,7-8,11-14H2,1-3H3/t16-,17+/m0/s1