1-[6-[[3-(3-methylimidazol-3-ium-1-yl)-2-oxidanyl-propyl]amino]hexylamino]butan-2-ol

Systemtic Name: 1-[6-[[3-(3-methylimidazol-3-ium-1-yl)-2-oxidanyl-propyl]amino]hexylamino]butan-2-ol Openeye Name: 1-[6-[[2-hydroxy-3-(3-methylimidazol-3-ium-1-yl)propyl]amino]hexylamino]butan-2-ol CAS Name: 1-[6-[[2-hydroxy-3-(3-methyl-1-imidazol-3-iumyl)propyl]amino]hexylamino]-2-butanol IUPAC Name: 1-[6-[[2-hydroxy-3-(3-methylimidazol-3-ium-1-yl)propyl]amino]hexylamino]butan-2-ol Traditional Name: 1-[6-[[2-hydroxy-3-(3-methylimidazol-3-ium-1-yl)propyl]amino]hexylamino]butan-2-ol Formula: C17H35N4O2+ MolecularWeight: 327.4854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNCCCCCCNCC(CN1C=C[N+](=C1)C)O)O

Isomeric SMILES

CCC(CNCCCCCCNCC(CN1C=C[N+](=C1)C)O)O

InChI

InChI=1S/C17H35N4O2/c1-3-16(22)12-18-8-6-4-5-7-9-19-13-17(23)14-21-11-10-20(2)15-21/h10-11,15-19,22-23H,3-9,12-14H2,1-2H3/q+1