(1,1-dimethylpyrrolidin-1-ium-2-yl)methyl benzoate iodide

Systemtic Name: (1,1-dimethylpyrrolidin-1-ium-2-yl)methyl benzoate iodide Openeye Name: (1,1-dimethylpyrrolidin-1-ium-2-yl)methyl benzoate iodide CAS Name: benzoic acid (1,1-dimethyl-2-pyrrolidin-1-iumyl)methyl ester iodide IUPAC Name: (1,1-dimethylpyrrolidin-1-ium-2-yl)methyl benzoate iodide Traditional Name: benzoic acid (1,1-dimethylpyrrolidin-1-ium-2-yl)methyl ester iodide Formula: C14H20INO2 MolecularWeight: 361.21857

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1COC(=O)C2=CC=CC=C2)C.[I-]

Isomeric SMILES

C[N+]1(CCCC1COC(=O)C2=CC=CC=C2)C.[I-]

InChI

InChI=1S/C14H20NO2.HI/c1-15(2)10-6-9-13(15)11-17-14(16)12-7-4-3-5-8-12;/h3-5,7-8,13H,6,9-11H2,1-2H3;1H/q+1;/p-1