(5-ethanoyl-2-methoxy-phenyl)methyl 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate CAS Name: 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate Traditional Name: 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]butyric acid (5-acetyl-2-methoxy-benzyl) ester Formula: C22H24F3NO6S MolecularWeight: 487.48927

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=C(C=CC(=C1)C(=O)C)OC)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)C(C(=O)OCC1=C(C=CC(=C1)C(=O)C)OC)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C22H24F3NO6S/c1-13(2)20(26-33(29,30)18-7-5-6-17(11-18)22(23,24)25)21(28)32-12-16-10-15(14(3)27)8-9-19(16)31-4/h5-11,13,20,26H,12H2,1-4H3