6-[2-(1,4-dimethyl-4-propan-2-yl-piperazine-1,4-diium-1-yl)ethyl]-1-methyl-pyrimidin-1-ium

Systemtic Name: 6-[2-(1,4-dimethyl-4-propan-2-yl-piperazine-1,4-diium-1-yl)ethyl]-1-methyl-pyrimidin-1-ium Openeye Name: 6-[2-(4-isopropyl-1,4-dimethyl-piperazine-1,4-diium-1-yl)ethyl]-1-methyl-pyrimidin-1-ium CAS Name: 6-[2-(1,4-dimethyl-4-propan-2-yl-1-piperazine-1,4-diiumyl)ethyl]-1-methylpyrimidin-1-ium IUPAC Name: 6-[2-(1,4-dimethyl-4-propan-2-ylpiperazine-1,4-diium-1-yl)ethyl]-1-methylpyrimidin-1-ium Traditional Name: 6-[2-(4-isopropyl-1,4-dimethyl-piperazine-1,4-diium-1-yl)ethyl]-1-methyl-pyrimidin-1-ium Formula: C16H31N4+3 MolecularWeight: 279.44414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1(CC[N+](CC1)(C)CCC2=[N+](C=NC=C2)C)C

Isomeric SMILES

CC(C)[N+]1(CC[N+](CC1)(C)CCC2=[N+](C=NC=C2)C)C

InChI

InChI=1S/C16H31N4/c1-15(2)20(5)12-10-19(4,11-13-20)9-7-16-6-8-17-14-18(16)3/h6,8,14-15H,7,9-13H2,1-5H3/q+3