methyl (2R)-1-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-2-carboxylate

Systemtic Name: methyl (2R)-1-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-2-carboxylate Openeye Name: methyl (2R)-1-[[2-(2-furyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-2-carboxylate CAS Name: (2R)-1-[[2-(2-furanyl)-5-methyl-4-oxazolyl]methyl]-2-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl (2R)-1-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-2-carboxylate Traditional Name: (2R)-1-[[2-(2-furyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-2-carboxylic acid methyl ester Formula: C16H21N2O4+ MolecularWeight: 305.34894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CO2)C[NH+]3CCCCC3C(=O)OC

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CO2)C[NH+]3CCCC[C@@H]3C(=O)OC

InChI

InChI=1S/C16H20N2O4/c1-11-12(17-15(22-11)14-7-5-9-21-14)10-18-8-4-3-6-13(18)16(19)20-2/h5,7,9,13H,3-4,6,8,10H2,1-2H3/p+1/t13-/m1/s1