4-[2-[6-(4-methylpiperazin-1-yl)hexylamino]ethyl]benzene-1,2-diol trihydrobromide

Systemtic Name: 4-[2-[6-(4-methylpiperazin-1-yl)hexylamino]ethyl]benzene-1,2-diol trihydrobromide Openeye Name: 4-[2-[6-(4-methylpiperazin-1-yl)hexylamino]ethyl]benzene-1,2-diol trihydrobromide CAS Name: 4-[2-[6-(4-methyl-1-piperazinyl)hexylamino]ethyl]benzene-1,2-diol trihydrobromide IUPAC Name: 4-[2-[6-(4-methylpiperazin-1-yl)hexylamino]ethyl]benzene-1,2-diol trihydrobromide Traditional Name: 4-[2-[6-(4-methylpiperazino)hexylamino]ethyl]pyrocatechol trihydrobromide Formula: C19H36Br3N3O2 MolecularWeight: 578.22004

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCCCCNCCC2=CC(=C(C=C2)O)O.Br.Br.Br

Isomeric SMILES

CN1CCN(CC1)CCCCCCNCCC2=CC(=C(C=C2)O)O.Br.Br.Br

InChI

InChI=1S/C19H33N3O2.3BrH/c1-21-12-14-22(15-13-21)11-5-3-2-4-9-20-10-8-17-6-7-18(23)19(24)16-17;;;/h6-7,16,20,23-24H,2-5,8-15H2,1H3;3*1H