trimethyl-[4-[3-[4-(trimethylazaniumyl)phenoxy]propoxy]phenyl]azanium diiodide

Systemtic Name: trimethyl-[4-[3-[4-(trimethylazaniumyl)phenoxy]propoxy]phenyl]azanium diiodide Openeye Name: trimethyl-[4-[3-[4-(trimethylammonio)phenoxy]propoxy]phenyl]ammonium diiodide CAS Name: trimethyl-[4-[3-[4-(trimethylammonio)phenoxy]propoxy]phenyl]ammonium diiodide IUPAC Name: trimethyl-[4-[3-[4-(trimethylazaniumyl)phenoxy]propoxy]phenyl]azanium diiodide Traditional Name: trimethyl-[4-[3-[4-(trimethylammonio)phenoxy]propoxy]phenyl]ammonium diiodide Formula: C21H32I2N2O2 MolecularWeight: 598.29992

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=C(C=C1)OCCCOC2=CC=C(C=C2)[N+](C)(C)C.[I-].[I-]

Isomeric SMILES

C[N+](C)(C)C1=CC=C(C=C1)OCCCOC2=CC=C(C=C2)[N+](C)(C)C.[I-].[I-]

InChI

InChI=1S/C21H32N2O2.2HI/c1-22(2,3)18-8-12-20(13-9-18)24-16-7-17-25-21-14-10-19(11-15-21)23(4,5)6;;/h8-15H,7,16-17H2,1-6H3;2*1H/q+2;;/p-2