2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[4-(2-phenoxyethyl)-1-piperazine-1,4-diiumyl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C22H32N6O2+2 MolecularWeight: 412.52848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCOC2=CC=CC=C2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1C[NH+](CC[NH+]1CCOC2=CC=CC=C2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C22H30N6O2/c29-21(27-13-15-28(16-14-27)22-23-7-4-8-24-22)19-26-11-9-25(10-12-26)17-18-30-20-5-2-1-3-6-20/h1-8H,9-19H2/p+2