methyl 2-(piperidin-1-ium-4-ylmethyl)furan-3-carboxylate

Systemtic Name: methyl 2-(piperidin-1-ium-4-ylmethyl)furan-3-carboxylate Openeye Name: methyl 2-(piperidin-1-ium-4-ylmethyl)furan-3-carboxylate CAS Name: 2-(4-piperidin-1-iumylmethyl)-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-(piperidin-1-ium-4-ylmethyl)furan-3-carboxylate Traditional Name: 2-(piperidin-1-ium-4-ylmethyl)furan-3-carboxylic acid methyl ester Formula: C12H18NO3+ MolecularWeight: 224.27622

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC=C1)CC2CC[NH2+]CC2

Isomeric SMILES

COC(=O)C1=C(OC=C1)CC2CC[NH2+]CC2

InChI

InChI=1S/C12H17NO3/c1-15-12(14)10-4-7-16-11(10)8-9-2-5-13-6-3-9/h4,7,9,13H,2-3,5-6,8H2,1H3/p+1