1-(phenylmethyl)-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]piperazine-1,4-diium

Systemtic Name: 1-(phenylmethyl)-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]piperazine-1,4-diium Openeye Name: 1-benzyl-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]piperazine-1,4-diium CAS Name: 1-(phenylmethyl)-4-[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]piperazine-1,4-diium IUPAC Name: 1-benzyl-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]piperazine-1,4-diium Traditional Name: 1-benzyl-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]piperazine-1,4-diium Formula: C22H33N4+3 MolecularWeight: 353.52422

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)CC4=CC=CC=N4

Isomeric SMILES

C1C[NH+](CCC1[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)CC4=CC=CC=N4

InChI

InChI=1S/C22H30N4/c1-2-6-20(7-3-1)18-25-14-16-26(17-15-25)22-9-12-24(13-10-22)19-21-8-4-5-11-23-21/h1-8,11,22H,9-10,12-19H2/p+3