methyl 1-[2-oxidanyl-3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-oxidanyl-3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-hydroxy-3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]piperidine-4-carboxylate CAS Name: 1-[2-hydroxy-3-[3-(1-pyrrolidinylmethyl)phenoxy]propyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-hydroxy-3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]piperidine-4-carboxylate Traditional Name: 1-[2-hydroxy-3-[3-(pyrrolidinomethyl)phenoxy]propyl]isonipecotic acid methyl ester Formula: C21H32N2O4 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)CC(COC2=CC=CC(=C2)CN3CCCC3)O

Isomeric SMILES

COC(=O)C1CCN(CC1)CC(COC2=CC=CC(=C2)CN3CCCC3)O

InChI

InChI=1S/C21H32N2O4/c1-26-21(25)18-7-11-23(12-8-18)15-19(24)16-27-20-6-4-5-17(13-20)14-22-9-2-3-10-22/h4-6,13,18-19,24H,2-3,7-12,14-16H2,1H3