2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-5-[2,2,2-tris(fluoranyl)ethoxymethyl]pyridine-3-carboxylic acid

Systemtic Name: 2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-5-[2,2,2-tris(fluoranyl)ethoxymethyl]pyridine-3-carboxylic acid Openeye Name: 2-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)-5-(2,2,2-trifluoroethoxymethyl)pyridine-3-carboxylic acid CAS Name: 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-5-(2,2,2-trifluoroethoxymethyl)-3-pyridinecarboxylic acid IUPAC Name: 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-5-(2,2,2-trifluoroethoxymethyl)pyridine-3-carboxylic acid Traditional Name: 2-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-5-(2,2,2-trifluoroethoxymethyl)nicotinic acid Formula: C16H18F3N3O4 MolecularWeight: 373.32703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)NC(=N1)C2=NC=C(C=C2C(=O)O)COCC(F)(F)F)C

Isomeric SMILES

CC(C)C1(C(=O)NC(=N1)C2=NC=C(C=C2C(=O)O)COCC(F)(F)F)C

InChI

InChI=1S/C16H18F3N3O4/c1-8(2)15(3)14(25)21-12(22-15)11-10(13(23)24)4-9(5-20-11)6-26-7-16(17,18)19/h4-5,8H,6-7H2,1-3H3,(H,23,24)(H,21,22,25)