5-[butanoyl(pyridin-2-yl)amino]-2-methyl-3-(trifluoromethyl)benzoic acid

Systemtic Name: 5-[butanoyl(pyridin-2-yl)amino]-2-methyl-3-(trifluoromethyl)benzoic acid Openeye Name: 5-[butanoyl(2-pyridyl)amino]-2-methyl-3-(trifluoromethyl)benzoic acid CAS Name: 2-methyl-5-[1-oxobutyl(2-pyridinyl)amino]-3-(trifluoromethyl)benzoic acid IUPAC Name: 5-[butanoyl(pyridin-2-yl)amino]-2-methyl-3-(trifluoromethyl)benzoic acid Traditional Name: 5-[butyryl(2-pyridyl)amino]-2-methyl-3-(trifluoromethyl)benzoic acid Formula: C18H17F3N2O3 MolecularWeight: 366.33439

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=CC=CC=N1)C2=CC(=C(C(=C2)C(=O)O)C)C(F)(F)F

Isomeric SMILES

CCCC(=O)N(C1=CC=CC=N1)C2=CC(=C(C(=C2)C(=O)O)C)C(F)(F)F

InChI

InChI=1S/C18H17F3N2O3/c1-3-6-16(24)23(15-7-4-5-8-22-15)12-9-13(17(25)26)11(2)14(10-12)18(19,20)21/h4-5,7-10H,3,6H2,1-2H3,(H,25,26)