[3-(trifluoromethyl)phenyl]methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate CAS Name: 4,5-dimethoxy-2-[(2-methyl-1-oxopropyl)amino]benzoic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate Traditional Name: 2-(isobutyrylamino)-4,5-dimethoxy-benzoic acid [3-(trifluoromethyl)benzyl] ester Formula: C21H22F3NO5 MolecularWeight: 425.39829

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC2=CC(=CC=C2)C(F)(F)F)OC)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC2=CC(=CC=C2)C(F)(F)F)OC)OC

InChI

InChI=1S/C21H22F3NO5/c1-12(2)19(26)25-16-10-18(29-4)17(28-3)9-15(16)20(27)30-11-13-6-5-7-14(8-13)21(22,23)24/h5-10,12H,11H2,1-4H3,(H,25,26)