5-azanyl-6,7-dimethyl-4-oxidanylidene-1-(trifluoromethyl)cinnoline-3-carboxylic acid

Systemtic Name: 5-azanyl-6,7-dimethyl-4-oxidanylidene-1-(trifluoromethyl)cinnoline-3-carboxylic acid Openeye Name: 5-amino-6,7-dimethyl-4-oxo-1-(trifluoromethyl)cinnoline-3-carboxylic acid CAS Name: 5-amino-6,7-dimethyl-4-oxo-1-(trifluoromethyl)-3-cinnolinecarboxylic acid IUPAC Name: 5-amino-6,7-dimethyl-4-oxo-1-(trifluoromethyl)cinnoline-3-carboxylic acid Traditional Name: 5-amino-4-keto-6,7-dimethyl-1-(trifluoromethyl)cinnoline-3-carboxylic acid Formula: C12H10F3N3O3 MolecularWeight: 301.22131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1C)N)C(=O)C(=NN2C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=CC2=C(C(=C1C)N)C(=O)C(=NN2C(F)(F)F)C(=O)O

InChI

InChI=1S/C12H10F3N3O3/c1-4-3-6-7(8(16)5(4)2)10(19)9(11(20)21)17-18(6)12(13,14)15/h3H,16H2,1-2H3,(H,20,21)