ethyl 2-[(3S,4S)-3-ethyl-1-[(1R)-2-oxidanyl-1-phenyl-ethyl]piperidin-4-yl]ethanoate

Systemtic Name: ethyl 2-[(3S,4S)-3-ethyl-1-[(1R)-2-oxidanyl-1-phenyl-ethyl]piperidin-4-yl]ethanoate Openeye Name: ethyl 2-[(3S,4S)-3-ethyl-1-[(1R)-2-hydroxy-1-phenyl-ethyl]-4-piperidyl]acetate CAS Name: 2-[(3S,4S)-3-ethyl-1-[(1R)-2-hydroxy-1-phenylethyl]-4-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3S,4S)-3-ethyl-1-[(1R)-2-hydroxy-1-phenylethyl]piperidin-4-yl]acetate Traditional Name: 2-[(3S,4S)-3-ethyl-1-[(1R)-2-hydroxy-1-phenyl-ethyl]-4-piperidyl]acetic acid ethyl ester Formula: C19H29NO3 MolecularWeight: 319.43846

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCC1CC(=O)OCC)C(CO)C2=CC=CC=C2

Isomeric SMILES

CC[C@@H]1CN(CC[C@H]1CC(=O)OCC)[C@@H](CO)C2=CC=CC=C2

InChI

InChI=1S/C19H29NO3/c1-3-15-13-20(11-10-17(15)12-19(22)23-4-2)18(14-21)16-8-6-5-7-9-16/h5-9,15,17-18,21H,3-4,10-14H2,1-2H3/t15-,17+,18+/m1/s1