3-[[4-[(3R)-1-(pyridin-4-ylmethyl)pyrrolidin-1-ium-3-yl]piperidin-1-ium-1-yl]methyl]pyridine

Systemtic Name: 3-[[4-[(3R)-1-(pyridin-4-ylmethyl)pyrrolidin-1-ium-3-yl]piperidin-1-ium-1-yl]methyl]pyridine Openeye Name: 3-[[4-[(3R)-1-(4-pyridylmethyl)pyrrolidin-1-ium-3-yl]piperidin-1-ium-1-yl]methyl]pyridine CAS Name: 3-[[4-[(3R)-1-(pyridin-4-ylmethyl)-3-pyrrolidin-1-iumyl]-1-piperidin-1-iumyl]methyl]pyridine IUPAC Name: 3-[[4-[(3R)-1-(pyridin-4-ylmethyl)pyrrolidin-1-ium-3-yl]piperidin-1-ium-1-yl]methyl]pyridine Traditional Name: 3-[[4-[(3R)-1-(4-pyridylmethyl)pyrrolidin-1-ium-3-yl]piperidin-1-ium-1-yl]methyl]pyridine Formula: C21H30N4+2 MolecularWeight: 338.4897

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2CC[NH+](C2)CC3=CC=NC=C3)CC4=CN=CC=C4

Isomeric SMILES

C1C[NH+](C[C@H]1C2CC[NH+](CC2)CC3=CN=CC=C3)CC4=CC=NC=C4

InChI

InChI=1S/C21H28N4/c1-2-19(14-23-8-1)16-24-11-5-20(6-12-24)21-7-13-25(17-21)15-18-3-9-22-10-4-18/h1-4,8-10,14,20-21H,5-7,11-13,15-17H2/p+2/t21-/m0/s1