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

Systemtic Name: methyl (2R)-1-[[2-(2,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-2-carboxylate Openeye Name: methyl (2R)-1-[[2-(2,4-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-2-carboxylate CAS Name: (2R)-1-[[2-(2,4-dimethoxyphenyl)-5-methyl-4-oxazolyl]methyl]-2-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl (2R)-1-[[2-(2,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-1-ium-2-carboxylate Traditional Name: (2R)-1-[[2-(2,4-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]piperidin-1-ium-2-carboxylic acid methyl ester Formula: C20H27N2O5+ MolecularWeight: 375.43878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O5/c1-13-16(12-22-10-6-5-7-17(22)20(23)26-4)21-19(27-13)15-9-8-14(24-2)11-18(15)25-3/h8-9,11,17H,5-7,10,12H2,1-4H3/p+1/t17-/m1/s1