phenacyl 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate

Systemtic Name: phenacyl 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate Openeye Name: phenacyl 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate CAS Name: 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid phenacyl ester IUPAC Name: phenacyl 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate Traditional Name: 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butyric acid phenacyl ester Formula: C20H20F3NO5S MolecularWeight: 443.43671

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C1=CC=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)C1=CC=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C20H20F3NO5S/c1-13(2)18(19(26)29-12-17(25)14-7-4-3-5-8-14)24-30(27,28)16-10-6-9-15(11-16)20(21,22)23/h3-11,13,18,24H,12H2,1-2H3