4-[(4-carboxylato-2-chloranyl-5-methoxy-phenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: 4-[(4-carboxylato-2-chloranyl-5-methoxy-phenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: 4-(4-carboxylato-2-chloro-5-methoxy-anilino)-8-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(4-carboxylato-2-chloro-5-methoxyanilino)-8-(trifluoromethyl)-3-quinolinecarboxylate IUPAC Name: 4-(4-carboxylato-2-chloro-5-methoxyanilino)-8-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(4-carboxylato-2-chloro-5-methoxy-anilino)-8-(trifluoromethyl)quinoline-3-carboxylate Formula: C19H10ClF3N2O5-2 MolecularWeight: 438.74131

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)[O-])Cl)NC2=C3C=CC=C(C3=NC=C2C(=O)[O-])C(F)(F)F

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)[O-])Cl)NC2=C3C=CC=C(C3=NC=C2C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C19H12ClF3N2O5/c1-30-14-6-13(12(20)5-9(14)17(26)27)25-15-8-3-2-4-11(19(21,22)23)16(8)24-7-10(15)18(28)29/h2-7H,1H3,(H,24,25)(H,26,27)(H,28,29)/p-2