(5S)-3-(2,4,5-trimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylate

Systemtic Name: (5S)-3-(2,4,5-trimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylate Openeye Name: (5S)-3-(2,4,5-trimethoxyphenyl)-4,5-dihydroisoxazole-5-carboxylate CAS Name: (5S)-3-(2,4,5-trimethoxyphenyl)-4,5-dihydroisoxazole-5-carboxylate IUPAC Name: (5S)-3-(2,4,5-trimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylate Traditional Name: (5S)-3-asaryl-2-isoxazoline-5-carboxylate Formula: C13H14NO6- MolecularWeight: 280.25336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=NOC(C2)C(=O)[O-])OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2=NO[C@@H](C2)C(=O)[O-])OC)OC

InChI

InChI=1S/C13H15NO6/c1-17-9-6-11(19-3)10(18-2)4-7(9)8-5-12(13(15)16)20-14-8/h4,6,12H,5H2,1-3H3,(H,15,16)/p-1/t12-/m0/s1