1-[4-(1,4-dimethyl-4-pyrimidin-2-yl-piperazine-1,4-diium-1-yl)butyl]-1,4,4-trimethyl-piperidin-1-ium-2,6-dione

Systemtic Name: 1-[4-(1,4-dimethyl-4-pyrimidin-2-yl-piperazine-1,4-diium-1-yl)butyl]-1,4,4-trimethyl-piperidin-1-ium-2,6-dione Openeye Name: 1-[4-(1,4-dimethyl-4-pyrimidin-2-yl-piperazine-1,4-diium-1-yl)butyl]-1,4,4-trimethyl-piperidin-1-ium-2,6-dione CAS Name: 1-[4-[1,4-dimethyl-4-(2-pyrimidinyl)-1-piperazine-1,4-diiumyl]butyl]-1,4,4-trimethylpiperidin-1-ium-2,6-dione IUPAC Name: 1-[4-(1,4-dimethyl-4-pyrimidin-2-ylpiperazine-1,4-diium-1-yl)butyl]-1,4,4-trimethylpiperidin-1-ium-2,6-dione Traditional Name: 1-[4-[1,4-dimethyl-4-(2-pyrimidyl)piperazine-1,4-diium-1-yl]butyl]-1,4,4-trimethyl-piperidin-1-ium-2,6-quinone Formula: C22H38N5O2+3 MolecularWeight: 404.56942

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)[N+](C(=O)C1)(C)CCCC[N+]2(CC[N+](CC2)(C)C3=NC=CC=N3)C)C

Isomeric SMILES

CC1(CC(=O)[N+](C(=O)C1)(C)CCCC[N+]2(CC[N+](CC2)(C)C3=NC=CC=N3)C)C

InChI

InChI=1S/C22H38N5O2/c1-22(2)17-19(28)27(5,20(29)18-22)12-7-6-11-25(3)13-15-26(4,16-14-25)21-23-9-8-10-24-21/h8-10H,6-7,11-18H2,1-5H3/q+3