2-(methylamino)-4-[2-[6-(phenethylamino)hexylamino]ethyl]phenol trihydrobromide

Systemtic Name: 2-(methylamino)-4-[2-[6-(phenethylamino)hexylamino]ethyl]phenol trihydrobromide Openeye Name: 2-(methylamino)-4-[2-[6-(phenethylamino)hexylamino]ethyl]phenol trihydrobromide CAS Name: 2-(methylamino)-4-[2-[6-(phenethylamino)hexylamino]ethyl]phenol trihydrobromide IUPAC Name: 2-(methylamino)-4-[2-[6-(phenethylamino)hexylamino]ethyl]phenol trihydrobromide Traditional Name: 2-(methylamino)-4-[2-[6-(phenethylamino)hexylamino]ethyl]phenol trihydrobromide Formula: C23H38Br3N3O MolecularWeight: 612.27932

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=CC(=C1)CCNCCCCCCNCCC2=CC=CC=C2)O.Br.Br.Br

Isomeric SMILES

CNC1=C(C=CC(=C1)CCNCCCCCCNCCC2=CC=CC=C2)O.Br.Br.Br

InChI

InChI=1S/C23H35N3O.3BrH/c1-24-22-19-21(11-12-23(22)27)14-18-26-16-8-3-2-7-15-25-17-13-20-9-5-4-6-10-20;;;/h4-6,9-12,19,24-27H,2-3,7-8,13-18H2,1H3;3*1H