4-[(3-nitrophenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylic acid

Systemtic Name: 4-[(3-nitrophenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylic acid Openeye Name: 4-(3-nitroanilino)-8-(trifluoromethyl)quinoline-3-carboxylic acid CAS Name: 4-(3-nitroanilino)-8-(trifluoromethyl)-3-quinolinecarboxylic acid IUPAC Name: 4-(3-nitroanilino)-8-(trifluoromethyl)quinoline-3-carboxylic acid Traditional Name: 4-(3-nitroanilino)-8-(trifluoromethyl)quinoline-3-carboxylic acid Formula: C17H10F3N3O4 MolecularWeight: 377.27421

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=C3C=CC=C(C3=NC=C2C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=C3C=CC=C(C3=NC=C2C(=O)O)C(F)(F)F

InChI

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