1-methyl-4-[2-(1-methyl-1-phenethyl-piperidin-1-ium-4-yl)ethyl]-1-phenethyl-piperidin-1-ium bromide

Systemtic Name: 1-methyl-4-[2-(1-methyl-1-phenethyl-piperidin-1-ium-4-yl)ethyl]-1-phenethyl-piperidin-1-ium bromide Openeye Name: 1-methyl-4-[2-(1-methyl-1-phenethyl-piperidin-1-ium-4-yl)ethyl]-1-phenethyl-piperidin-1-ium bromide CAS Name: 1-methyl-4-[2-(1-methyl-1-phenethyl-4-piperidin-1-iumyl)ethyl]-1-phenethylpiperidin-1-ium bromide IUPAC Name: 1-methyl-4-[2-(1-methyl-1-phenethylpiperidin-1-ium-4-yl)ethyl]-1-phenethylpiperidin-1-ium bromide Traditional Name: 1-methyl-4-[2-(1-methyl-1-phenethyl-piperidin-1-ium-4-yl)ethyl]-1-phenethyl-piperidin-1-ium bromide Formula: C30H46BrN2+ MolecularWeight: 514.60364

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)CCC2CC[N+](CC2)(C)CCC3=CC=CC=C3)CCC4=CC=CC=C4.[Br-]

Isomeric SMILES

C[N+]1(CCC(CC1)CCC2CC[N+](CC2)(C)CCC3=CC=CC=C3)CCC4=CC=CC=C4.[Br-]

InChI

InChI=1S/C30H46N2.BrH/c1-31(21-15-27-9-5-3-6-10-27)23-17-29(18-24-31)13-14-30-19-25-32(2,26-20-30)22-16-28-11-7-4-8-12-28;/h3-12,29-30H,13-26H2,1-2H3;1H/q+2;/p-1