5-(dimethylamino)-4-oxidanylidene-1-[4-(trifluoromethyl)phenyl]cinnoline-3-carboxylic acid

Systemtic Name: 5-(dimethylamino)-4-oxidanylidene-1-[4-(trifluoromethyl)phenyl]cinnoline-3-carboxylic acid Openeye Name: 5-(dimethylamino)-4-oxo-1-[4-(trifluoromethyl)phenyl]cinnoline-3-carboxylic acid CAS Name: 5-(dimethylamino)-4-oxo-1-[4-(trifluoromethyl)phenyl]-3-cinnolinecarboxylic acid IUPAC Name: 5-(dimethylamino)-4-oxo-1-[4-(trifluoromethyl)phenyl]cinnoline-3-carboxylic acid Traditional Name: 5-(dimethylamino)-4-keto-1-[4-(trifluoromethyl)phenyl]cinnoline-3-carboxylic acid Formula: C18H14F3N3O3 MolecularWeight: 377.31727

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C(=O)C(=NN2C3=CC=C(C=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

CN(C)C1=CC=CC2=C1C(=O)C(=NN2C3=CC=C(C=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C18H14F3N3O3/c1-23(2)12-4-3-5-13-14(12)16(25)15(17(26)27)22-24(13)11-8-6-10(7-9-11)18(19,20)21/h3-9H,1-2H3,(H,26,27)