trimethyl-[3-(1-methyl-4-phenethyl-piperidin-1-ium-1-yl)propyl]azanium dibromide

Systemtic Name: trimethyl-[3-(1-methyl-4-phenethyl-piperidin-1-ium-1-yl)propyl]azanium dibromide Openeye Name: trimethyl-[3-(1-methyl-4-phenethyl-piperidin-1-ium-1-yl)propyl]ammonium dibromide CAS Name: trimethyl-[3-(1-methyl-4-phenethyl-1-piperidin-1-iumyl)propyl]ammonium dibromide IUPAC Name: trimethyl-[3-(1-methyl-4-phenethylpiperidin-1-ium-1-yl)propyl]azanium dibromide Traditional Name: trimethyl-[3-(1-methyl-4-phenethyl-piperidin-1-ium-1-yl)propyl]ammonium dibromide Formula: C20H36Br2N2 MolecularWeight: 464.32124

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)CCC2=CC=CC=C2)CCC[N+](C)(C)C.[Br-].[Br-]

Isomeric SMILES

C[N+]1(CCC(CC1)CCC2=CC=CC=C2)CCC[N+](C)(C)C.[Br-].[Br-]

InChI

InChI=1S/C20H36N2.2BrH/c1-21(2,3)15-8-16-22(4)17-13-20(14-18-22)12-11-19-9-6-5-7-10-19;;/h5-7,9-10,20H,8,11-18H2,1-4H3;2*1H/q+2;;/p-2