methyl 1-[(2S)-2-oxidanyl-3-[4-[(3-propan-2-yloxypropylamino)methyl]phenoxy]propyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(2S)-2-oxidanyl-3-[4-[(3-propan-2-yloxypropylamino)methyl]phenoxy]propyl]piperidine-4-carboxylate Openeye Name: methyl 1-[(2S)-2-hydroxy-3-[4-[(3-isopropoxypropylamino)methyl]phenoxy]propyl]piperidine-4-carboxylate CAS Name: 1-[(2S)-2-hydroxy-3-[4-[(3-propan-2-yloxypropylamino)methyl]phenoxy]propyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(2S)-2-hydroxy-3-[4-[(3-propan-2-yloxypropylamino)methyl]phenoxy]propyl]piperidine-4-carboxylate Traditional Name: 1-[(2S)-2-hydroxy-3-[4-[(3-isopropoxypropylamino)methyl]phenoxy]propyl]isonipecotic acid methyl ester Formula: C23H38N2O5 MolecularWeight: 422.55822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNCC1=CC=C(C=C1)OCC(CN2CCC(CC2)C(=O)OC)O

Isomeric SMILES

CC(C)OCCCNCC1=CC=C(C=C1)OC[C@H](CN2CCC(CC2)C(=O)OC)O

InChI

InChI=1S/C23H38N2O5/c1-18(2)29-14-4-11-24-15-19-5-7-22(8-6-19)30-17-21(26)16-25-12-9-20(10-13-25)23(27)28-3/h5-8,18,20-21,24,26H,4,9-17H2,1-3H3/t21-/m0/s1