(4-acetamidophenyl) 5-methyl-2-[[2-(trifluoromethyl)pyridin-4-yl]amino]benzoate

Systemtic Name: (4-acetamidophenyl) 5-methyl-2-[[2-(trifluoromethyl)pyridin-4-yl]amino]benzoate Openeye Name: (4-acetamidophenyl) 5-methyl-2-[[2-(trifluoromethyl)-4-pyridyl]amino]benzoate CAS Name: 5-methyl-2-[[2-(trifluoromethyl)-4-pyridinyl]amino]benzoic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 5-methyl-2-[[2-(trifluoromethyl)pyridin-4-yl]amino]benzoate Traditional Name: 5-methyl-2-[[2-(trifluoromethyl)-4-pyridyl]amino]benzoic acid (4-acetamidophenyl) ester Formula: C22H18F3N3O3 MolecularWeight: 429.39183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=CC(=NC=C2)C(F)(F)F)C(=O)OC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=CC(=NC=C2)C(F)(F)F)C(=O)OC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H18F3N3O3/c1-13-3-8-19(28-16-9-10-26-20(12-16)22(23,24)25)18(11-13)21(30)31-17-6-4-15(5-7-17)27-14(2)29/h3-12H,1-2H3,(H,26,28)(H,27,29)