N-phenethyl-1-(1-pyridin-2-ylcarbonylpiperidin-4-yl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-phenethyl-1-(1-pyridin-2-ylcarbonylpiperidin-4-yl)piperidin-1-ium-4-carboxamide Openeye Name: N-phenethyl-1-[1-(pyridine-2-carbonyl)-4-piperidyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[oxo(2-pyridinyl)methyl]-4-piperidinyl]-N-phenethyl-4-piperidin-1-iumcarboxamide IUPAC Name: N-phenethyl-1-[1-(pyridine-2-carbonyl)piperidin-4-yl]piperidin-1-ium-4-carboxamide Traditional Name: N-phenethyl-1-(1-picolinoyl-4-piperidyl)piperidin-1-ium-4-carboxamide Formula: C25H33N4O2+ MolecularWeight: 421.55512

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCCC2=CC=CC=C2)C3CCN(CC3)C(=O)C4=CC=CC=N4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCCC2=CC=CC=C2)C3CCN(CC3)C(=O)C4=CC=CC=N4

InChI

InChI=1S/C25H32N4O2/c30-24(27-15-9-20-6-2-1-3-7-20)21-10-16-28(17-11-21)22-12-18-29(19-13-22)25(31)23-8-4-5-14-26-23/h1-8,14,21-22H,9-13,15-19H2,(H,27,30)/p+1