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A1I0F

Summary
Name:[3-[(1~{S})-1-oxidanyl-2-piperidin-1-yl-ethyl]-5-piperidin-1-ylcarbonyloxy-phenyl] piperidine-1-carboxylate
Formula:C25 H37 N3 O5
Formal charge:0
Formula weight:459.578 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7[3-[(1~{S})-1-oxidanyl-2-piperidin-1-yl-ethyl]-5-piperidin-1-ylcarbonyloxy-phenyl] piperidine-1-carboxylate

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C25H37N3O5/c29-23(19-26-10-4-1-5-11-26)20-16-21(32-24(30)27-12-6-2-7-13-27)18-22(17-20)33-25(31)28-14-8-3-9-15-28/h16-18,23,29H,1-15,19H2
InChIKeyInChI1.06BWDDGVMFEKGIRS-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385O[C@H](CN1CCCCC1)c2cc(OC(=O)N3CCCCC3)cc(OC(=O)N4CCCCC4)c2
SMILESCACTVS3.385O[CH](CN1CCCCC1)c2cc(OC(=O)N3CCCCC3)cc(OC(=O)N4CCCCC4)c2
SMILES_CANONICALOpenEye OEToolkits2.0.7c1c(cc(cc1OC(=O)N2CCCCC2)OC(=O)N3CCCCC3)[C@@H](CN4CCCCC4)O
SMILESOpenEye OEToolkits2.0.7c1c(cc(cc1OC(=O)N2CCCCC2)OC(=O)N3CCCCC3)C(CN4CCCCC4)O

250835

PDB entries from 2026-03-18

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