N-(pyridin-2-ylmethyl)-1-[1-[(2R)-1-pyridin-2-ylpropan-2-yl]piperidin-1-ium-4-yl]piperidine-4-carboxamide

Systemtic Name: N-(pyridin-2-ylmethyl)-1-[1-[(2R)-1-pyridin-2-ylpropan-2-yl]piperidin-1-ium-4-yl]piperidine-4-carboxamide Openeye Name: 1-[1-[(1R)-1-methyl-2-(2-pyridyl)ethyl]piperidin-1-ium-4-yl]-N-(2-pyridylmethyl)piperidine-4-carboxamide CAS Name: N-(2-pyridinylmethyl)-1-[1-[(2R)-1-(2-pyridinyl)propan-2-yl]-4-piperidin-1-iumyl]-4-piperidinecarboxamide IUPAC Name: N-(pyridin-2-ylmethyl)-1-[1-[(2R)-1-pyridin-2-ylpropan-2-yl]piperidin-1-ium-4-yl]piperidine-4-carboxamide Traditional Name: 1-[1-[(1R)-1-methyl-2-(2-pyridyl)ethyl]piperidin-1-ium-4-yl]-N-(2-pyridylmethyl)isonipecotamide Formula: C25H36N5O+ MolecularWeight: 422.58624

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=N1)[NH+]2CCC(CC2)N3CCC(CC3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

C[C@H](CC1=CC=CC=N1)[NH+]2CCC(CC2)N3CCC(CC3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C25H35N5O/c1-20(18-22-6-2-4-12-26-22)29-16-10-24(11-17-29)30-14-8-21(9-15-30)25(31)28-19-23-7-3-5-13-27-23/h2-7,12-13,20-21,24H,8-11,14-19H2,1H3,(H,28,31)/p+1/t20-/m1/s1