2-(5,6-dimethoxy-2-methyl-2,3-dihydro-1H-isoindol-2-ium-1-yl)ethanal iodide

Systemtic Name: 2-(5,6-dimethoxy-2-methyl-2,3-dihydro-1H-isoindol-2-ium-1-yl)ethanal iodide Openeye Name: 2-(5,6-dimethoxy-2-methyl-isoindolin-2-ium-1-yl)acetaldehyde iodide CAS Name: 2-(5,6-dimethoxy-2-methyl-2,3-dihydro-1H-isoindol-2-ium-1-yl)acetaldehyde iodide IUPAC Name: 2-(5,6-dimethoxy-2-methyl-2,3-dihydro-1H-isoindol-2-ium-1-yl)acetaldehyde iodide Traditional Name: 2-(5,6-dimethoxy-2-methyl-isoindolin-2-ium-1-yl)acetaldehyde iodide Formula: C13H18INO3 MolecularWeight: 363.19139

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC2=CC(=C(C=C2C1CC=O)OC)OC.[I-]

Isomeric SMILES

C[NH+]1CC2=CC(=C(C=C2C1CC=O)OC)OC.[I-]

InChI

InChI=1S/C13H17NO3.HI/c1-14-8-9-6-12(16-2)13(17-3)7-10(9)11(14)4-5-15;/h5-7,11H,4,8H2,1-3H3;1H