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4-phenyl-2-(trifluoromethylsulfonyl)butanoic acid

4-phenyl-2-(trifluoromethylsulfonyl)butanoic acid

Systemtic Name:4-phenyl-2-(trifluoromethylsulfonyl)butanoic acid
Openeye Name:4-phenyl-2-(trifluoromethylsulfonyl)butanoic acid
CAS Name:4-phenyl-2-(trifluoromethylsulfonyl)butanoic acid
IUPAC Name:4-phenyl-2-(trifluoromethylsulfonyl)butanoic acid
Traditional Name:4-phenyl-2-triflyl-butyric acid
Formula: C11H11F3O4S
MolecularWeight: 296.26285
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C11H11F3O4S/c12-11(13,14)19(17,18)9(10(15)16)7-6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,15,16)


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