triethyl-[5-[4-[5-(triethylazaniumyl)pentyl]phenyl]pentyl]azanium diiodide

Systemtic Name: triethyl-[5-[4-[5-(triethylazaniumyl)pentyl]phenyl]pentyl]azanium diiodide Openeye Name: triethyl-[5-[4-[5-(triethylammonio)pentyl]phenyl]pentyl]ammonium diiodide CAS Name: triethyl-[5-[4-[5-(triethylammonio)pentyl]phenyl]pentyl]ammonium diiodide IUPAC Name: triethyl-[5-[4-[5-(triethylazaniumyl)pentyl]phenyl]pentyl]azanium diiodide Traditional Name: triethyl-[5-[4-[5-(triethylammonio)pentyl]phenyl]pentyl]ammonium diiodide Formula: C28H54I2N2 MolecularWeight: 672.5507

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCCCCC1=CC=C(C=C1)CCCCC[N+](CC)(CC)CC.[I-].[I-]

Isomeric SMILES

CC[N+](CC)(CC)CCCCCC1=CC=C(C=C1)CCCCC[N+](CC)(CC)CC.[I-].[I-]

InChI

InChI=1S/C28H54N2.2HI/c1-7-29(8-2,9-3)25-17-13-15-19-27-21-23-28(24-22-27)20-16-14-18-26-30(10-4,11-5)12-6;;/h21-24H,7-20,25-26H2,1-6H3;2*1H/q+2;;/p-2