1-butyl-2-[2-(2,4,6-trimethoxyphenyl)ethenyl]quinolin-1-ium iodide

Systemtic Name: 1-butyl-2-[2-(2,4,6-trimethoxyphenyl)ethenyl]quinolin-1-ium iodide Openeye Name: 1-butyl-2-[2-(2,4,6-trimethoxyphenyl)vinyl]quinolin-1-ium iodide CAS Name: 1-butyl-2-[2-(2,4,6-trimethoxyphenyl)ethenyl]quinolin-1-ium iodide IUPAC Name: 1-butyl-2-[2-(2,4,6-trimethoxyphenyl)ethenyl]quinolin-1-ium iodide Traditional Name: 1-butyl-2-[2-(2,4,6-trimethoxyphenyl)vinyl]quinolin-1-ium iodide Formula: C24H28INO3 MolecularWeight: 505.38849

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C(C=CC2=CC=CC=C21)C=CC3=C(C=C(C=C3OC)OC)OC.[I-]

Isomeric SMILES

CCCC[N+]1=C(C=CC2=CC=CC=C21)C=CC3=C(C=C(C=C3OC)OC)OC.[I-]

InChI

InChI=1S/C24H28NO3.HI/c1-5-6-15-25-19(12-11-18-9-7-8-10-22(18)25)13-14-21-23(27-3)16-20(26-2)17-24(21)28-4;/h7-14,16-17H,5-6,15H2,1-4H3;1H/q+1;/p-1