6-methyl-4-oxidanylidene-1-[4-(trifluoromethyl)phenyl]pyridazine-3,5-dicarboxylic acid

Systemtic Name: 6-methyl-4-oxidanylidene-1-[4-(trifluoromethyl)phenyl]pyridazine-3,5-dicarboxylic acid Openeye Name: 6-methyl-4-oxo-1-[4-(trifluoromethyl)phenyl]pyridazine-3,5-dicarboxylic acid CAS Name: 6-methyl-4-oxo-1-[4-(trifluoromethyl)phenyl]pyridazine-3,5-dicarboxylic acid IUPAC Name: 6-methyl-4-oxo-1-[4-(trifluoromethyl)phenyl]pyridazine-3,5-dicarboxylic acid Traditional Name: 4-keto-6-methyl-1-[4-(trifluoromethyl)phenyl]pyridazine-3,5-dicarboxylic acid Formula: C14H9F3N2O5 MolecularWeight: 342.22687

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=NN1C2=CC=C(C=C2)C(F)(F)F)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C(=O)C(=NN1C2=CC=C(C=C2)C(F)(F)F)C(=O)O)C(=O)O

InChI

InChI=1S/C14H9F3N2O5/c1-6-9(12(21)22)11(20)10(13(23)24)18-19(6)8-4-2-7(3-5-8)14(15,16)17/h2-5H,1H3,(H,21,22)(H,23,24)