4-[(4-carboxylatophenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: 4-[(4-carboxylatophenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: 4-(4-carboxylatoanilino)-8-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(4-carboxylatoanilino)-8-(trifluoromethyl)-3-quinolinecarboxylate IUPAC Name: 4-(4-carboxylatoanilino)-8-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(4-carboxylatoanilino)-8-(trifluoromethyl)quinoline-3-carboxylate Formula: C18H9F3N2O4-2 MolecularWeight: 374.27027

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN=C2C(=C1)C(F)(F)F)C(=O)[O-])NC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=CN=C2C(=C1)C(F)(F)F)C(=O)[O-])NC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C18H11F3N2O4/c19-18(20,21)13-3-1-2-11-14(12(17(26)27)8-22-15(11)13)23-10-6-4-9(5-7-10)16(24)25/h1-8H,(H,22,23)(H,24,25)(H,26,27)/p-2