[(2R)-1-piperidin-1-ium-1-ylpropan-2-yl] furan-2-carboxylate

Systemtic Name: [(2R)-1-piperidin-1-ium-1-ylpropan-2-yl] furan-2-carboxylate Openeye Name: [(1R)-1-methyl-2-piperidin-1-ium-1-yl-ethyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [(2R)-1-(1-piperidin-1-iumyl)propan-2-yl] ester IUPAC Name: [(2R)-1-piperidin-1-ium-1-ylpropan-2-yl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [(1R)-1-methyl-2-piperidin-1-ium-1-yl-ethyl] ester Formula: C13H20NO3+ MolecularWeight: 238.3028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCCCC1)OC(=O)C2=CC=CO2

Isomeric SMILES

C[C@H](C[NH+]1CCCCC1)OC(=O)C2=CC=CO2

InChI

InChI=1S/C13H19NO3/c1-11(10-14-7-3-2-4-8-14)17-13(15)12-6-5-9-16-12/h5-6,9,11H,2-4,7-8,10H2,1H3/p+1/t11-/m1/s1