1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)propyl ethanoate iodide

Systemtic Name: 1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)propyl ethanoate iodide Openeye Name: 1-(2,3,3-trimethylindolin-1-ium-1-yl)propyl acetate iodide CAS Name: acetic acid 1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)propyl ester iodide IUPAC Name: 1-(2,3,3-trimethyl-1,2-dihydroindol-1-ium-1-yl)propyl acetate iodide Traditional Name: acetic acid 1-(2,3,3-trimethylindolin-1-ium-1-yl)propyl ester iodide Formula: C16H24INO2 MolecularWeight: 389.27173

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Descriptors Computed from Structure

Canonical SMILES:

CCC([NH+]1C(C(C2=CC=CC=C21)(C)C)C)OC(=O)C.[I-]

Isomeric SMILES

CCC([NH+]1C(C(C2=CC=CC=C21)(C)C)C)OC(=O)C.[I-]

InChI

InChI=1S/C16H23NO2.HI/c1-6-15(19-12(3)18)17-11(2)16(4,5)13-9-7-8-10-14(13)17;/h7-11,15H,6H2,1-5H3;1H