3-methyl-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]quinoline-4-carboxylic acid

Systemtic Name: 3-methyl-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]quinoline-4-carboxylic acid Openeye Name: 3-methyl-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]quinoline-4-carboxylic acid CAS Name: 3-methyl-2-[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-4-quinolinecarboxylic acid IUPAC Name: 3-methyl-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]quinoline-4-carboxylic acid Traditional Name: 3-methyl-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cinchoninic acid Formula: C16H12F3N3O2 MolecularWeight: 335.28059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC3=CC=CC=C3C(=C2C)C(=O)O)C(F)(F)F

Isomeric SMILES

CC1=CC(=NN1C2=NC3=CC=CC=C3C(=C2C)C(=O)O)C(F)(F)F

InChI

InChI=1S/C16H12F3N3O2/c1-8-7-12(16(17,18)19)21-22(8)14-9(2)13(15(23)24)10-5-3-4-6-11(10)20-14/h3-7H,1-2H3,(H,23,24)