ethyl 1-[(2S)-2-oxidanyl-3-[(1R)-1-phenylpropoxy]propyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(2S)-2-oxidanyl-3-[(1R)-1-phenylpropoxy]propyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(2S)-2-hydroxy-3-[(1R)-1-phenylpropoxy]propyl]piperidine-4-carboxylate CAS Name: 1-[(2S)-2-hydroxy-3-[(1R)-1-phenylpropoxy]propyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2S)-2-hydroxy-3-[(1R)-1-phenylpropoxy]propyl]piperidine-4-carboxylate Traditional Name: 1-[(2S)-2-hydroxy-3-[(1R)-1-phenylpropoxy]propyl]isonipecotic acid ethyl ester Formula: C20H31NO4 MolecularWeight: 349.46444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)OCC(CN2CCC(CC2)C(=O)OCC)O

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)OC[C@H](CN2CCC(CC2)C(=O)OCC)O

InChI

InChI=1S/C20H31NO4/c1-3-19(16-8-6-5-7-9-16)25-15-18(22)14-21-12-10-17(11-13-21)20(23)24-4-2/h5-9,17-19,22H,3-4,10-15H2,1-2H3/t18-,19+/m0/s1