(4-methoxyphenyl) 5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonate

Systemtic Name: (4-methoxyphenyl) 5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonate Openeye Name: (4-methoxyphenyl) 5-[5-(trifluoromethyl)isoxazol-3-yl]thiophene-2-sulfonate CAS Name: 5-[5-(trifluoromethyl)-3-isoxazolyl]-2-thiophenesulfonic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-2-sulfonate Traditional Name: 5-[5-(trifluoromethyl)isoxazol-3-yl]thiophene-2-sulfonic acid (4-methoxyphenyl) ester Formula: C15H10F3NO5S2 MolecularWeight: 405.36881

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(S2)C3=NOC(=C3)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(S2)C3=NOC(=C3)C(F)(F)F

InChI

InChI=1S/C15H10F3NO5S2/c1-22-9-2-4-10(5-3-9)24-26(20,21)14-7-6-12(25-14)11-8-13(23-19-11)15(16,17)18/h2-8H,1H3