2-[4-(3-pyridin-3-ylpropyl)piperazin-4-ium-1-yl]pyrimidine

Systemtic Name: 2-[4-(3-pyridin-3-ylpropyl)piperazin-4-ium-1-yl]pyrimidine Openeye Name: 2-[4-[3-(3-pyridyl)propyl]piperazin-4-ium-1-yl]pyrimidine CAS Name: 2-[4-[3-(3-pyridinyl)propyl]-1-piperazin-4-iumyl]pyrimidine IUPAC Name: 2-[4-(3-pyridin-3-ylpropyl)piperazin-4-ium-1-yl]pyrimidine Traditional Name: 2-[4-[3-(3-pyridyl)propyl]piperazin-4-ium-1-yl]pyrimidine Formula: C16H22N5+ MolecularWeight: 284.37938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC2=CN=CC=C2)C3=NC=CC=N3

Isomeric SMILES

C1CN(CC[NH+]1CCCC2=CN=CC=C2)C3=NC=CC=N3

InChI

InChI=1S/C16H21N5/c1-4-15(14-17-6-1)5-2-9-20-10-12-21(13-11-20)16-18-7-3-8-19-16/h1,3-4,6-8,14H,2,5,9-13H2/p+1