1-[1-[(2R)-2-oxidanyl-3-quinolin-5-yloxy-propyl]piperidin-2-yl]carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[1-[(2R)-2-oxidanyl-3-quinolin-5-yloxy-propyl]piperidin-2-yl]carbonylpiperidine-4-carboxylic acid Openeye Name: 1-[1-[(2R)-2-hydroxy-3-(5-quinolyloxy)propyl]piperidine-2-carbonyl]piperidine-4-carboxylic acid CAS Name: 1-[[1-[(2R)-2-hydroxy-3-(5-quinolinyloxy)propyl]-2-piperidinyl]-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-[(2R)-2-hydroxy-3-quinolin-5-yloxypropyl]piperidine-2-carbonyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-[(2R)-2-hydroxy-3-(5-quinolyloxy)propyl]pipecoloyl]isonipecotic acid Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)N2CCC(CC2)C(=O)O)CC(COC3=CC=CC4=C3C=CC=N4)O

Isomeric SMILES

C1CCN(C(C1)C(=O)N2CCC(CC2)C(=O)O)C[C@H](COC3=CC=CC4=C3C=CC=N4)O

InChI

InChI=1S/C24H31N3O5/c28-18(16-32-22-8-3-6-20-19(22)5-4-11-25-20)15-27-12-2-1-7-21(27)23(29)26-13-9-17(10-14-26)24(30)31/h3-6,8,11,17-18,21,28H,1-2,7,9-10,12-16H2,(H,30,31)/t18-,21?/m1/s1