1-naphthalen-2-yl-2-[1-[2-[1-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)piperidin-1-ium-1-yl]ethyl]piperidin-1-ium-1-yl]ethanone dibromide

Systemtic Name: 1-naphthalen-2-yl-2-[1-[2-[1-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)piperidin-1-ium-1-yl]ethyl]piperidin-1-ium-1-yl]ethanone dibromide Openeye Name: 1-(2-naphthyl)-2-[1-[2-[1-[2-(2-naphthyl)-2-oxo-ethyl]piperidin-1-ium-1-yl]ethyl]piperidin-1-ium-1-yl]ethanone dibromide CAS Name: 1-(2-naphthalenyl)-2-[1-[2-[1-[2-(2-naphthalenyl)-2-oxoethyl]-1-piperidin-1-iumyl]ethyl]-1-piperidin-1-iumyl]ethanone dibromide IUPAC Name: 1-naphthalen-2-yl-2-[1-[2-[1-(2-naphthalen-2-yl-2-oxoethyl)piperidin-1-ium-1-yl]ethyl]piperidin-1-ium-1-yl]ethanone dibromide Traditional Name: 2-[1-[2-[1-[2-keto-2-(2-naphthyl)ethyl]piperidin-1-ium-1-yl]ethyl]piperidin-1-ium-1-yl]-1-(2-naphthyl)ethanone dibromide Formula: C36H42Br2N2O2 MolecularWeight: 694.53888

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CC[N+]2(CCCCC2)CC(=O)C3=CC4=CC=CC=C4C=C3)CC(=O)C5=CC6=CC=CC=C6C=C5.[Br-].[Br-]

Isomeric SMILES

C1CC[N+](CC1)(CC[N+]2(CCCCC2)CC(=O)C3=CC4=CC=CC=C4C=C3)CC(=O)C5=CC6=CC=CC=C6C=C5.[Br-].[Br-]

InChI

InChI=1S/C36H42N2O2.2BrH/c39-35(33-17-15-29-11-3-5-13-31(29)25-33)27-37(19-7-1-8-20-37)23-24-38(21-9-2-10-22-38)28-36(40)34-18-16-30-12-4-6-14-32(30)26-34;;/h3-6,11-18,25-26H,1-2,7-10,19-24,27-28H2;2*1H/q+2;;/p-2