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

Systemtic Name: N-[3-[4-(4-oxidanyl-4-pyridin-2-yl-piperidin-1-ium-1-yl)piperidin-1-yl]phenyl]-4-phenyl-butanamide Openeye Name: N-[3-[4-[4-hydroxy-4-(2-pyridyl)piperidin-1-ium-1-yl]-1-piperidyl]phenyl]-4-phenyl-butanamide CAS Name: N-[3-[4-[4-hydroxy-4-(2-pyridinyl)-1-piperidin-1-iumyl]-1-piperidinyl]phenyl]-4-phenylbutanamide IUPAC Name: N-[3-[4-(4-hydroxy-4-pyridin-2-ylpiperidin-1-ium-1-yl)piperidin-1-yl]phenyl]-4-phenylbutanamide Traditional Name: N-[3-[4-[4-hydroxy-4-(2-pyridyl)piperidin-1-ium-1-yl]piperidino]phenyl]-4-phenyl-butyramide Formula: C31H39N4O2+ MolecularWeight: 499.66696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCC(CC2)(C3=CC=CC=N3)O)C4=CC(=CC=C4)NC(=O)CCCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1[NH+]2CCC(CC2)(C3=CC=CC=N3)O)C4=CC(=CC=C4)NC(=O)CCCC5=CC=CC=C5

InChI

InChI=1S/C31H38N4O2/c36-30(14-6-10-25-8-2-1-3-9-25)33-26-11-7-12-28(24-26)34-20-15-27(16-21-34)35-22-17-31(37,18-23-35)29-13-4-5-19-32-29/h1-5,7-9,11-13,19,24,27,37H,6,10,14-18,20-23H2,(H,33,36)/p+1