2-[(5-bromanylpyridin-2-yl)carbonyl-propan-2-yl-amino]-5-[3-(trifluoromethyl)pyridin-2-yl]oxy-benzoic acid

Systemtic Name: 2-[(5-bromanylpyridin-2-yl)carbonyl-propan-2-yl-amino]-5-[3-(trifluoromethyl)pyridin-2-yl]oxy-benzoic acid Openeye Name: 2-[(5-bromopyridine-2-carbonyl)-isopropyl-amino]-5-[[3-(trifluoromethyl)-2-pyridyl]oxy]benzoic acid CAS Name: 2-[[(5-bromo-2-pyridinyl)-oxomethyl]-propan-2-ylamino]-5-[[3-(trifluoromethyl)-2-pyridinyl]oxy]benzoic acid IUPAC Name: 2-[(5-bromopyridine-2-carbonyl)-propan-2-ylamino]-5-[3-(trifluoromethyl)pyridin-2-yl]oxybenzoic acid Traditional Name: 2-[(5-bromopicolinoyl)-isopropyl-amino]-5-[[3-(trifluoromethyl)-2-pyridyl]oxy]benzoic acid Formula: C22H17BrF3N3O4 MolecularWeight: 524.28729

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=C(C=C(C=C1)OC2=C(C=CC=N2)C(F)(F)F)C(=O)O)C(=O)C3=NC=C(C=C3)Br

Isomeric SMILES

CC(C)N(C1=C(C=C(C=C1)OC2=C(C=CC=N2)C(F)(F)F)C(=O)O)C(=O)C3=NC=C(C=C3)Br

InChI

InChI=1S/C22H17BrF3N3O4/c1-12(2)29(20(30)17-7-5-13(23)11-28-17)18-8-6-14(10-15(18)21(31)32)33-19-16(22(24,25)26)4-3-9-27-19/h3-12H,1-2H3,(H,31,32)