2-methyl-3-[2-(2,4,6-trimethoxyphenyl)ethenyl]isoquinolin-2-ium iodide

Systemtic Name: 2-methyl-3-[2-(2,4,6-trimethoxyphenyl)ethenyl]isoquinolin-2-ium iodide Openeye Name: 2-methyl-3-[2-(2,4,6-trimethoxyphenyl)vinyl]isoquinolin-2-ium iodide CAS Name: 2-methyl-3-[2-(2,4,6-trimethoxyphenyl)ethenyl]isoquinolin-2-ium iodide IUPAC Name: 2-methyl-3-[2-(2,4,6-trimethoxyphenyl)ethenyl]isoquinolin-2-ium iodide Traditional Name: 2-methyl-3-[2-(2,4,6-trimethoxyphenyl)vinyl]isoquinolin-2-ium iodide Formula: C21H22INO3 MolecularWeight: 463.30875

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=CC=CC=C2C=C1C=CC3=C(C=C(C=C3OC)OC)OC.[I-]

Isomeric SMILES

C[N+]1=CC2=CC=CC=C2C=C1C=CC3=C(C=C(C=C3OC)OC)OC.[I-]

InChI

InChI=1S/C21H22NO3.HI/c1-22-14-16-8-6-5-7-15(16)11-17(22)9-10-19-20(24-3)12-18(23-2)13-21(19)25-4;/h5-14H,1-4H3;1H/q+1;/p-1