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(4-propanoyl-2-propan-2-yl-phenyl) tris(fluoranyl)methanesulfonate

(4-propanoyl-2-propan-2-yl-phenyl) tris(fluoranyl)methanesulfonate

Systemtic Name:(4-propanoyl-2-propan-2-yl-phenyl) tris(fluoranyl)methanesulfonate
Openeye Name:(2-isopropyl-4-propanoyl-phenyl) trifluoromethanesulfonate
CAS Name:trifluoromethanesulfonic acid [4-(1-oxopropyl)-2-propan-2-ylphenyl] ester
IUPAC Name:(4-propanoyl-2-propan-2-ylphenyl) trifluoromethanesulfonate
Traditional Name:trifluoromethanesulfonic acid (2-isopropyl-4-propionyl-phenyl) ester
Formula: C13H15F3O4S
MolecularWeight: 324.31601
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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C(C=C1)OS(=O)(=O)C(F)(F)F)C(C)C


Isomeric SMILES

CCC(=O)C1=CC(=C(C=C1)OS(=O)(=O)C(F)(F)F)C(C)C


InChI

InChI=1S/C13H15F3O4S/c1-4-11(17)9-5-6-12(10(7-9)8(2)3)20-21(18,19)13(14,15)16/h5-8H,4H2,1-3H3


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