1-[1-methyl-4-[3-(3-methylimidazol-3-ium-1-yl)-2-oxidanyl-propyl]piperazin-1-ium-1-yl]butan-2-ol

Systemtic Name: 1-[1-methyl-4-[3-(3-methylimidazol-3-ium-1-yl)-2-oxidanyl-propyl]piperazin-1-ium-1-yl]butan-2-ol Openeye Name: 1-[4-[2-hydroxy-3-(3-methylimidazol-3-ium-1-yl)propyl]-1-methyl-piperazin-1-ium-1-yl]butan-2-ol CAS Name: 1-[4-[2-hydroxy-3-(3-methyl-1-imidazol-3-iumyl)propyl]-1-methyl-1-piperazin-1-iumyl]-2-butanol IUPAC Name: 1-[4-[2-hydroxy-3-(3-methylimidazol-3-ium-1-yl)propyl]-1-methylpiperazin-1-ium-1-yl]butan-2-ol Traditional Name: 1-[4-[2-hydroxy-3-(3-methylimidazol-3-ium-1-yl)propyl]-1-methyl-piperazin-1-ium-1-yl]butan-2-ol Formula: C16H32N4O2+2 MolecularWeight: 312.45088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C[N+]1(CCN(CC1)CC(CN2C=C[N+](=C2)C)O)C)O

Isomeric SMILES

CCC(C[N+]1(CCN(CC1)CC(CN2C=C[N+](=C2)C)O)C)O

InChI

InChI=1S/C16H32N4O2/c1-4-15(21)13-20(3)9-7-18(8-10-20)11-16(22)12-19-6-5-17(2)14-19/h5-6,14-16,21-22H,4,7-13H2,1-3H3/q+2