trimethyl-[4-[2-(1-methylquinolin-1-ium-2-yl)-2-phenyl-ethyl]phenyl]azanium diiodide

Systemtic Name: trimethyl-[4-[2-(1-methylquinolin-1-ium-2-yl)-2-phenyl-ethyl]phenyl]azanium diiodide Openeye Name: trimethyl-[4-[2-(1-methylquinolin-1-ium-2-yl)-2-phenyl-ethyl]phenyl]ammonium diiodide CAS Name: trimethyl-[4-[2-(1-methyl-2-quinolin-1-iumyl)-2-phenylethyl]phenyl]ammonium diiodide IUPAC Name: trimethyl-[4-[2-(1-methylquinolin-1-ium-2-yl)-2-phenylethyl]phenyl]azanium diiodide Traditional Name: trimethyl-[4-[2-(1-methylquinolin-1-ium-2-yl)-2-phenyl-ethyl]phenyl]ammonium diiodide Formula: C27H30I2N2 MolecularWeight: 636.34944

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC2=CC=CC=C21)C(CC3=CC=C(C=C3)[N+](C)(C)C)C4=CC=CC=C4.[I-].[I-]

Isomeric SMILES

C[N+]1=C(C=CC2=CC=CC=C21)C(CC3=CC=C(C=C3)[N+](C)(C)C)C4=CC=CC=C4.[I-].[I-]

InChI

InChI=1S/C27H30N2.2HI/c1-28-26-13-9-8-12-23(26)16-19-27(28)25(22-10-6-5-7-11-22)20-21-14-17-24(18-15-21)29(2,3)4;;/h5-19,25H,20H2,1-4H3;2*1H/q+2;;/p-2