4-azanyl-2-[bis(fluoranyl)methyl]-5-ethoxycarbonyl-6-(trifluoromethyl)pyridine-3-carboxylic acid

Systemtic Name: 4-azanyl-2-[bis(fluoranyl)methyl]-5-ethoxycarbonyl-6-(trifluoromethyl)pyridine-3-carboxylic acid Openeye Name: 4-amino-2-(difluoromethyl)-5-ethoxycarbonyl-6-(trifluoromethyl)pyridine-3-carboxylic acid CAS Name: 4-amino-2-(difluoromethyl)-5-ethoxycarbonyl-6-(trifluoromethyl)-3-pyridinecarboxylic acid IUPAC Name: 4-amino-2-(difluoromethyl)-5-ethoxycarbonyl-6-(trifluoromethyl)pyridine-3-carboxylic acid Traditional Name: 4-amino-5-carbethoxy-2-(difluoromethyl)-6-(trifluoromethyl)nicotinic acid Formula: C11H9F5N2O4 MolecularWeight: 328.192176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1N)C(=O)O)C(F)F)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1N)C(=O)O)C(F)F)C(F)(F)F

InChI

InChI=1S/C11H9F5N2O4/c1-2-22-10(21)4-5(17)3(9(19)20)6(8(12)13)18-7(4)11(14,15)16/h8H,2H2,1H3,(H2,17,18)(H,19,20)