[4-(3-morpholin-4-yl-3-oxidanylidene-propanoyl)-3-oxidanyl-phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [4-(3-morpholin-4-yl-3-oxidanylidene-propanoyl)-3-oxidanyl-phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [3-hydroxy-4-(3-morpholino-3-oxo-propanoyl)phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [3-hydroxy-4-[3-(4-morpholinyl)-1,3-dioxopropyl]phenyl] ester IUPAC Name: [3-hydroxy-4-(3-morpholin-4-yl-3-oxopropanoyl)phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [3-hydroxy-4-(3-keto-3-morpholino-propanoyl)phenyl] ester Formula: C14H14F3NO7S MolecularWeight: 397.32367

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CC(=O)C2=C(C=C(C=C2)OS(=O)(=O)C(F)(F)F)O

Isomeric SMILES

C1COCCN1C(=O)CC(=O)C2=C(C=C(C=C2)OS(=O)(=O)C(F)(F)F)O

InChI

InChI=1S/C14H14F3NO7S/c15-14(16,17)26(22,23)25-9-1-2-10(11(19)7-9)12(20)8-13(21)18-3-5-24-6-4-18/h1-2,7,19H,3-6,8H2