2-[4-[(3R)-1-(pyridin-4-ylmethyl)pyrrolidin-1-ium-3-yl]piperidin-1-yl]pyrimidine

Systemtic Name: 2-[4-[(3R)-1-(pyridin-4-ylmethyl)pyrrolidin-1-ium-3-yl]piperidin-1-yl]pyrimidine Openeye Name: 2-[4-[(3R)-1-(4-pyridylmethyl)pyrrolidin-1-ium-3-yl]-1-piperidyl]pyrimidine CAS Name: 2-[4-[(3R)-1-(pyridin-4-ylmethyl)-3-pyrrolidin-1-iumyl]-1-piperidinyl]pyrimidine IUPAC Name: 2-[4-[(3R)-1-(pyridin-4-ylmethyl)pyrrolidin-1-ium-3-yl]piperidin-1-yl]pyrimidine Traditional Name: 2-[4-[(3R)-1-(4-pyridylmethyl)pyrrolidin-1-ium-3-yl]piperidino]pyrimidine Formula: C19H26N5+ MolecularWeight: 324.44324

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1C2CCN(CC2)C3=NC=CC=N3)CC4=CC=NC=C4

Isomeric SMILES

C1C[NH+](C[C@H]1C2CCN(CC2)C3=NC=CC=N3)CC4=CC=NC=C4

InChI

InChI=1S/C19H25N5/c1-7-21-19(22-8-1)24-12-5-17(6-13-24)18-4-11-23(15-18)14-16-2-9-20-10-3-16/h1-3,7-10,17-18H,4-6,11-15H2/p+1/t18-/m0/s1