(1-methylpiperidin-1-ium-3-yl) furan-2-carboxylate chloride

Systemtic Name: (1-methylpiperidin-1-ium-3-yl) furan-2-carboxylate chloride Openeye Name: (1-methylpiperidin-1-ium-3-yl) furan-2-carboxylate chloride CAS Name: 2-furancarboxylic acid (1-methyl-3-piperidin-1-iumyl) ester chloride IUPAC Name: (1-methylpiperidin-1-ium-3-yl) furan-2-carboxylate chloride Traditional Name: furan-2-carboxylic acid (1-methylpiperidin-1-ium-3-yl) ester chloride Formula: C11H16ClNO3 MolecularWeight: 245.70264

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)OC(=O)C2=CC=CO2.[Cl-]

Isomeric SMILES

C[NH+]1CCCC(C1)OC(=O)C2=CC=CO2.[Cl-]

InChI

InChI=1S/C11H15NO3.ClH/c1-12-6-2-4-9(8-12)15-11(13)10-5-3-7-14-10;/h3,5,7,9H,2,4,6,8H2,1H3;1H