2-[[4-(3-ethoxyphenyl)-2-(trifluoromethyloxy)phenyl]amino]pyridine-3-carboxylic acid

Systemtic Name: 2-[[4-(3-ethoxyphenyl)-2-(trifluoromethyloxy)phenyl]amino]pyridine-3-carboxylic acid Openeye Name: 2-[4-(3-ethoxyphenyl)-2-(trifluoromethoxy)anilino]pyridine-3-carboxylic acid CAS Name: 2-[4-(3-ethoxyphenyl)-2-(trifluoromethoxy)anilino]-3-pyridinecarboxylic acid IUPAC Name: 2-[4-(3-ethoxyphenyl)-2-(trifluoromethoxy)anilino]pyridine-3-carboxylic acid Traditional Name: 2-[4-m-phenetyl-2-(trifluoromethoxy)anilino]nicotinic acid Formula: C21H17F3N2O4 MolecularWeight: 418.36589

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=CC(=C(C=C2)NC3=C(C=CC=N3)C(=O)O)OC(F)(F)F

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=CC(=C(C=C2)NC3=C(C=CC=N3)C(=O)O)OC(F)(F)F

InChI

InChI=1S/C21H17F3N2O4/c1-2-29-15-6-3-5-13(11-15)14-8-9-17(18(12-14)30-21(22,23)24)26-19-16(20(27)28)7-4-10-25-19/h3-12H,2H2,1H3,(H,25,26)(H,27,28)