8-methyl-4-oxidanylidene-1-[4-(trifluoromethyl)phenyl]cinnoline-3-carboxylic acid

Systemtic Name: 8-methyl-4-oxidanylidene-1-[4-(trifluoromethyl)phenyl]cinnoline-3-carboxylic acid Openeye Name: 8-methyl-4-oxo-1-[4-(trifluoromethyl)phenyl]cinnoline-3-carboxylic acid CAS Name: 8-methyl-4-oxo-1-[4-(trifluoromethyl)phenyl]-3-cinnolinecarboxylic acid IUPAC Name: 8-methyl-4-oxo-1-[4-(trifluoromethyl)phenyl]cinnoline-3-carboxylic acid Traditional Name: 4-keto-8-methyl-1-[4-(trifluoromethyl)phenyl]cinnoline-3-carboxylic acid Formula: C17H11F3N2O3 MolecularWeight: 348.27605

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(N=C(C2=O)C(=O)O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=CC2=C1N(N=C(C2=O)C(=O)O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H11F3N2O3/c1-9-3-2-4-12-14(9)22(21-13(15(12)23)16(24)25)11-7-5-10(6-8-11)17(18,19)20/h2-8H,1H3,(H,24,25)