1-(4-methylpiperazin-1-yl)-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentane-1,5-dione

Systemtic Name: 1-(4-methylpiperazin-1-yl)-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentane-1,5-dione Openeye Name: 1-(4-methylpiperazin-1-yl)-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentane-1,5-dione CAS Name: 1-(4-methyl-1-piperazinyl)-5-[4-(2-pyridin-1-iumyl)-1-piperazinyl]pentane-1,5-dione IUPAC Name: 1-(4-methylpiperazin-1-yl)-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentane-1,5-dione Traditional Name: 1-(4-methylpiperazino)-5-(4-pyridin-1-ium-2-ylpiperazino)pentane-1,5-dione Formula: C19H30N5O2+ MolecularWeight: 360.4738

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CCCC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CN1CCN(CC1)C(=O)CCCC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C19H29N5O2/c1-21-9-11-23(12-10-21)18(25)6-4-7-19(26)24-15-13-22(14-16-24)17-5-2-3-8-20-17/h2-3,5,8H,4,6-7,9-16H2,1H3/p+1