triethyl-[1-[4-[1-(triethylazaniumyl)butyl]phenyl]butyl]azanium diiodide

Systemtic Name: triethyl-[1-[4-[1-(triethylazaniumyl)butyl]phenyl]butyl]azanium diiodide Openeye Name: triethyl-[1-[4-[1-(triethylammonio)butyl]phenyl]butyl]ammonium diiodide CAS Name: triethyl-[1-[4-[1-(triethylammonio)butyl]phenyl]butyl]ammonium diiodide IUPAC Name: triethyl-[1-[4-[1-(triethylazaniumyl)butyl]phenyl]butyl]azanium diiodide Traditional Name: triethyl-[1-[4-[1-(triethylammonio)butyl]phenyl]butyl]ammonium diiodide Formula: C26H50I2N2 MolecularWeight: 644.49754

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)C(CCC)[N+](CC)(CC)CC)[N+](CC)(CC)CC.[I-].[I-]

Isomeric SMILES

CCCC(C1=CC=C(C=C1)C(CCC)[N+](CC)(CC)CC)[N+](CC)(CC)CC.[I-].[I-]

InChI

InChI=1S/C26H50N2.2HI/c1-9-17-25(27(11-3,12-4)13-5)23-19-21-24(22-20-23)26(18-10-2)28(14-6,15-7)16-8;;/h19-22,25-26H,9-18H2,1-8H3;2*1H/q+2;;/p-2