1,7-dipyridin-3-ylheptan-4-yl 1-(2-oxidanyl-3-quinolin-5-yloxy-propyl)piperidine-4-carboxylate

Systemtic Name: 1,7-dipyridin-3-ylheptan-4-yl 1-(2-oxidanyl-3-quinolin-5-yloxy-propyl)piperidine-4-carboxylate Openeye Name: [4-(3-pyridyl)-1-[3-(3-pyridyl)propyl]butyl] 1-[2-hydroxy-3-(5-quinolyloxy)propyl]piperidine-4-carboxylate CAS Name: 1-[2-hydroxy-3-(5-quinolinyloxy)propyl]-4-piperidinecarboxylic acid 1,7-bis(3-pyridinyl)heptan-4-yl ester IUPAC Name: 1,7-dipyridin-3-ylheptan-4-yl 1-(2-hydroxy-3-quinolin-5-yloxypropyl)piperidine-4-carboxylate Traditional Name: 1-[2-hydroxy-3-(5-quinolyloxy)propyl]isonipecotic acid [4-(3-pyridyl)-1-[3-(3-pyridyl)propyl]butyl] ester Formula: C35H42N4O4 MolecularWeight: 582.73238

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC(CCCC2=CN=CC=C2)CCCC3=CN=CC=C3)CC(COC4=CC=CC5=C4C=CC=N5)O

Isomeric SMILES

C1CN(CCC1C(=O)OC(CCCC2=CN=CC=C2)CCCC3=CN=CC=C3)CC(COC4=CC=CC5=C4C=CC=N5)O

InChI

InChI=1S/C35H42N4O4/c40-30(26-42-34-15-3-14-33-32(34)13-6-20-38-33)25-39-21-16-29(17-22-39)35(41)43-31(11-1-7-27-9-4-18-36-23-27)12-2-8-28-10-5-19-37-24-28/h3-6,9-10,13-15,18-20,23-24,29-31,40H,1-2,7-8,11-12,16-17,21-22,25-26H2