N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-1-pyridin-4-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-1-pyridin-4-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-1-(pyridine-4-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo(pyridin-4-yl)methyl]-N-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]-4-piperidinecarboxamide IUPAC Name: N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]-1-(pyridine-4-carbonyl)piperidine-4-carboxamide Traditional Name: 1-isonicotinoyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]isonipecotamide Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2CCN(CC2)C(=O)C3=CC=NC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2CCN(CC2)C(=O)C3=CC=NC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H30N4O2/c29-23(20-10-16-28(17-11-20)24(30)21-8-12-25-13-9-21)26-18-22(27-14-4-5-15-27)19-6-2-1-3-7-19/h1-3,6-9,12-13,20,22H,4-5,10-11,14-18H2,(H,26,29)/p+1/t22-/m0/s1