(1-methylpiperidin-1-ium-4-yl) 5-iodanylfuran-2-carboxylate

Systemtic Name: (1-methylpiperidin-1-ium-4-yl) 5-iodanylfuran-2-carboxylate Openeye Name: (1-methylpiperidin-1-ium-4-yl) 5-iodofuran-2-carboxylate CAS Name: 5-iodo-2-furancarboxylic acid (1-methyl-4-piperidin-1-iumyl) ester IUPAC Name: (1-methylpiperidin-1-ium-4-yl) 5-iodofuran-2-carboxylate Traditional Name: 5-iodofuran-2-carboxylic acid (1-methylpiperidin-1-ium-4-yl) ester Formula: C11H15INO3+ MolecularWeight: 336.14617

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)OC(=O)C2=CC=C(O2)I

Isomeric SMILES

C[NH+]1CCC(CC1)OC(=O)C2=CC=C(O2)I

InChI

InChI=1S/C11H14INO3/c1-13-6-4-8(5-7-13)15-11(14)9-2-3-10(12)16-9/h2-3,8H,4-7H2,1H3/p+1