3-[(4-carboxyphenyl)amino]-7-(trifluoromethyl)quinoxaline-2-carboxylic acid

Systemtic Name: 3-[(4-carboxyphenyl)amino]-7-(trifluoromethyl)quinoxaline-2-carboxylic acid Openeye Name: 3-(4-carboxyanilino)-7-(trifluoromethyl)quinoxaline-2-carboxylic acid CAS Name: 3-(4-carboxyanilino)-7-(trifluoromethyl)-2-quinoxalinecarboxylic acid IUPAC Name: 3-(4-carboxyanilino)-7-(trifluoromethyl)quinoxaline-2-carboxylic acid Traditional Name: 3-(4-carboxyanilino)-7-(trifluoromethyl)quinoxaline-2-carboxylic acid Formula: C17H10F3N3O4 MolecularWeight: 377.27421

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC2=NC3=C(C=C(C=C3)C(F)(F)F)N=C2C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC2=NC3=C(C=C(C=C3)C(F)(F)F)N=C2C(=O)O

InChI

InChI=1S/C17H10F3N3O4/c18-17(19,20)9-3-6-11-12(7-9)22-13(16(26)27)14(23-11)21-10-4-1-8(2-5-10)15(24)25/h1-7H,(H,21,23)(H,24,25)(H,26,27)