1-benzofuran-2-ylmethyl-diethyl-[2-(triethylazaniumyl)ethyl]azanium diiodide

Systemtic Name: 1-benzofuran-2-ylmethyl-diethyl-[2-(triethylazaniumyl)ethyl]azanium diiodide Openeye Name: benzofuran-2-ylmethyl-diethyl-[2-(triethylammonio)ethyl]ammonium diiodide CAS Name: 2-benzofuranylmethyl-diethyl-[2-(triethylammonio)ethyl]ammonium diiodide IUPAC Name: 1-benzofuran-2-ylmethyl-diethyl-[2-(triethylazaniumyl)ethyl]azanium diiodide Traditional Name: benzofuran-2-ylmethyl-diethyl-[2-(triethylammonio)ethyl]ammonium diiodide Formula: C21H36I2N2O MolecularWeight: 586.33228

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CC[N+](CC)(CC)CC1=CC2=CC=CC=C2O1.[I-].[I-]

Isomeric SMILES

CC[N+](CC)(CC)CC[N+](CC)(CC)CC1=CC2=CC=CC=C2O1.[I-].[I-]

InChI

InChI=1S/C21H36N2O.2HI/c1-6-22(7-2,8-3)15-16-23(9-4,10-5)18-20-17-19-13-11-12-14-21(19)24-20;;/h11-14,17H,6-10,15-16,18H2,1-5H3;2*1H/q+2;;/p-2