2-[2-[dimethyl-(phenylmethyl)azaniumyl]ethyl-phenyl-amino]ethyl-dimethyl-(phenylmethyl)azanium dibromide

Systemtic Name: 2-[2-[dimethyl-(phenylmethyl)azaniumyl]ethyl-phenyl-amino]ethyl-dimethyl-(phenylmethyl)azanium dibromide Openeye Name: benzyl-[2-[N-[2-[benzyl(dimethyl)ammonio]ethyl]anilino]ethyl]-dimethyl-ammonium dibromide CAS Name: 2-[N-[2-[dimethyl-(phenylmethyl)ammonio]ethyl]anilino]ethyl-dimethyl-(phenylmethyl)ammonium dibromide IUPAC Name: benzyl-[2-[N-[2-[benzyl(dimethyl)azaniumyl]ethyl]anilino]ethyl]-dimethylazanium dibromide Traditional Name: benzyl-[2-[N-[2-[benzyl(dimethyl)ammonio]ethyl]anilino]ethyl]-dimethyl-ammonium dibromide Formula: C28H39Br2N3 MolecularWeight: 577.43736

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCN(CC[N+](C)(C)CC1=CC=CC=C1)C2=CC=CC=C2)CC3=CC=CC=C3.[Br-].[Br-]

Isomeric SMILES

C[N+](C)(CCN(CC[N+](C)(C)CC1=CC=CC=C1)C2=CC=CC=C2)CC3=CC=CC=C3.[Br-].[Br-]

InChI

InChI=1S/C28H39N3.2BrH/c1-30(2,24-26-14-8-5-9-15-26)22-20-29(28-18-12-7-13-19-28)21-23-31(3,4)25-27-16-10-6-11-17-27;;/h5-19H,20-25H2,1-4H3;2*1H/q+2;;/p-2