[3-(1,3-benzodioxol-5-yl)-3-oxidanylidene-propyl]-trimethyl-azanium iodide

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-3-oxidanylidene-propyl]-trimethyl-azanium iodide Openeye Name: [3-(1,3-benzodioxol-5-yl)-3-oxo-propyl]-trimethyl-ammonium iodide CAS Name: [3-(1,3-benzodioxol-5-yl)-3-oxopropyl]-trimethylammonium iodide IUPAC Name: [3-(1,3-benzodioxol-5-yl)-3-oxopropyl]-trimethylazanium iodide Traditional Name: [3-(1,3-benzodioxol-5-yl)-3-keto-propyl]-trimethyl-ammonium iodide Formula: C13H18INO3 MolecularWeight: 363.19139

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCC(=O)C1=CC2=C(C=C1)OCO2.[I-]

Isomeric SMILES

C[N+](C)(C)CCC(=O)C1=CC2=C(C=C1)OCO2.[I-]

InChI

InChI=1S/C13H18NO3.HI/c1-14(2,3)7-6-11(15)10-4-5-12-13(8-10)17-9-16-12;/h4-5,8H,6-7,9H2,1-3H3;1H/q+1;/p-1