1-[1-[(2-azanylpyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]-N-(pyridin-2-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-[(2-azanylpyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]-N-(pyridin-2-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[1-[(2-aminopyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]-N-(2-pyridylmethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[(2-amino-5-pyrimidinyl)methyl]-4-piperidin-1-iumyl]-N-(2-pyridinylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-[(2-aminopyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]-N-(pyridin-2-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[1-[(2-aminopyrimidin-5-yl)methyl]piperidin-1-ium-4-yl]-N-(2-pyridylmethyl)piperidin-1-ium-4-carboxamide Formula: C22H33N7O+2 MolecularWeight: 411.54372

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCC2=CC=CC=N2)C3CC[NH+](CC3)CC4=CN=C(N=C4)N

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCC2=CC=CC=N2)C3CC[NH+](CC3)CC4=CN=C(N=C4)N

InChI

InChI=1S/C22H31N7O/c23-22-26-13-17(14-27-22)16-28-9-6-20(7-10-28)29-11-4-18(5-12-29)21(30)25-15-19-3-1-2-8-24-19/h1-3,8,13-14,18,20H,4-7,9-12,15-16H2,(H,25,30)(H2,23,26,27)/p+2