2,4-dimethyl-6-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]pyrimidine

Systemtic Name: 2,4-dimethyl-6-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]pyrimidine Openeye Name: 2,4-dimethyl-6-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]pyrimidine CAS Name: 2,4-dimethyl-6-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]pyrimidine IUPAC Name: 2,4-dimethyl-6-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]pyrimidine Traditional Name: 2,4-dimethyl-6-[(4-pyridin-1-ium-2-ylpiperazino)methyl]pyrimidine Formula: C16H22N5+ MolecularWeight: 284.37938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)CN2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CC1=CC(=NC(=N1)C)CN2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C16H21N5/c1-13-11-15(19-14(2)18-13)12-20-7-9-21(10-8-20)16-5-3-4-6-17-16/h3-6,11H,7-10,12H2,1-2H3/p+1