dimethyl (4R,5R)-4-(4-methoxyphenyl)-2-oxidanidyl-4,5-dihydro-1,2-oxazol-2-ium-3,5-dicarboxylate

Systemtic Name: dimethyl (4R,5R)-4-(4-methoxyphenyl)-2-oxidanidyl-4,5-dihydro-1,2-oxazol-2-ium-3,5-dicarboxylate Openeye Name: dimethyl (4R,5R)-4-(4-methoxyphenyl)-2-oxido-4,5-dihydroisoxazol-2-ium-3,5-dicarboxylate CAS Name: (4R,5R)-4-(4-methoxyphenyl)-2-oxido-4,5-dihydroisoxazol-2-ium-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4R,5R)-4-(4-methoxyphenyl)-2-oxido-4,5-dihydro-1,2-oxazol-2-ium-3,5-dicarboxylate Traditional Name: (4R,5R)-4-(4-methoxyphenyl)-2-oxido-2-isoxazolin-2-ium-3,5-dicarboxylic acid dimethyl ester Formula: C14H15NO7 MolecularWeight: 309.2714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(O[N+](=C2C(=O)OC)[O-])C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2[C@@H](O[N+](=C2C(=O)OC)[O-])C(=O)OC

InChI

InChI=1S/C14H15NO7/c1-19-9-6-4-8(5-7-9)10-11(13(16)20-2)15(18)22-12(10)14(17)21-3/h4-7,10,12H,1-3H3/t10-,12-/m1/s1