N-[4-[4-(4-oxidanyl-4-pyridin-3-yl-piperidin-1-ium-1-yl)piperidin-1-yl]phenyl]-2-phenoxy-ethanamide

Systemtic Name: N-[4-[4-(4-oxidanyl-4-pyridin-3-yl-piperidin-1-ium-1-yl)piperidin-1-yl]phenyl]-2-phenoxy-ethanamide Openeye Name: N-[4-[4-[4-hydroxy-4-(3-pyridyl)piperidin-1-ium-1-yl]-1-piperidyl]phenyl]-2-phenoxy-acetamide CAS Name: N-[4-[4-[4-hydroxy-4-(3-pyridinyl)-1-piperidin-1-iumyl]-1-piperidinyl]phenyl]-2-phenoxyacetamide IUPAC Name: N-[4-[4-(4-hydroxy-4-pyridin-3-ylpiperidin-1-ium-1-yl)piperidin-1-yl]phenyl]-2-phenoxyacetamide Traditional Name: N-[4-[4-[4-hydroxy-4-(3-pyridyl)piperidin-1-ium-1-yl]piperidino]phenyl]-2-phenoxy-acetamide Formula: C29H35N4O3+ MolecularWeight: 487.6132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCC(CC2)(C3=CN=CC=C3)O)C4=CC=C(C=C4)NC(=O)COC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1[NH+]2CCC(CC2)(C3=CN=CC=C3)O)C4=CC=C(C=C4)NC(=O)COC5=CC=CC=C5

InChI

InChI=1S/C29H34N4O3/c34-28(22-36-27-6-2-1-3-7-27)31-24-8-10-25(11-9-24)32-17-12-26(13-18-32)33-19-14-29(35,15-20-33)23-5-4-16-30-21-23/h1-11,16,21,26,35H,12-15,17-20,22H2,(H,31,34)/p+1