azanyl-[3-[4-[2-[4-[3-[azanyl(dimethyl)azaniumyl]-2-oxidanyl-propoxy]phenyl]propan-2-yl]phenoxy]-2-oxidanyl-propyl]-dimethyl-azanium dichloride

Systemtic Name: azanyl-[3-[4-[2-[4-[3-[azanyl(dimethyl)azaniumyl]-2-oxidanyl-propoxy]phenyl]propan-2-yl]phenoxy]-2-oxidanyl-propyl]-dimethyl-azanium dichloride Openeye Name: amino-[3-[4-[1-[4-[3-[amino(dimethyl)ammonio]-2-hydroxy-propoxy]phenyl]-1-methyl-ethyl]phenoxy]-2-hydroxy-propyl]-dimethyl-ammonium dichloride CAS Name: amino-[3-[4-[2-[4-[3-[amino(dimethyl)ammonio]-2-hydroxypropoxy]phenyl]propan-2-yl]phenoxy]-2-hydroxypropyl]-dimethylammonium dichloride IUPAC Name: amino-[3-[4-[2-[4-[3-[amino(dimethyl)azaniumyl]-2-hydroxypropoxy]phenyl]propan-2-yl]phenoxy]-2-hydroxypropyl]-dimethylazanium dichloride Traditional Name: amino-[3-[4-[1-[4-[3-[amino(dimethyl)ammonio]-2-hydroxy-propoxy]phenyl]-1-methyl-ethyl]phenoxy]-2-hydroxy-propyl]-dimethyl-ammonium dichloride Formula: C25H42Cl2N4O4 MolecularWeight: 533.53138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)OCC(C[N+](C)(C)N)O)C2=CC=C(C=C2)OCC(C[N+](C)(C)N)O.[Cl-].[Cl-]

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)OCC(C[N+](C)(C)N)O)C2=CC=C(C=C2)OCC(C[N+](C)(C)N)O.[Cl-].[Cl-]

InChI

InChI=1S/C25H42N4O4.2ClH/c1-25(2,19-7-11-23(12-8-19)32-17-21(30)15-28(3,4)26)20-9-13-24(14-10-20)33-18-22(31)16-29(5,6)27;;/h7-14,21-22,30-31H,15-18,26-27H2,1-6H3;2*1H/q+2;;/p-2