methyl 2-[(4-chlorophenyl)amino]-3-oxidanyl-8-(trifluoromethyl)quinoline-4-carboxylate

Systemtic Name: methyl 2-[(4-chlorophenyl)amino]-3-oxidanyl-8-(trifluoromethyl)quinoline-4-carboxylate Openeye Name: methyl 2-(4-chloroanilino)-3-hydroxy-8-(trifluoromethyl)quinoline-4-carboxylate CAS Name: 2-(4-chloroanilino)-3-hydroxy-8-(trifluoromethyl)-4-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-chloroanilino)-3-hydroxy-8-(trifluoromethyl)quinoline-4-carboxylate Traditional Name: 2-(4-chloroanilino)-3-hydroxy-8-(trifluoromethyl)cinchoninic acid methyl ester Formula: C18H12ClF3N2O3 MolecularWeight: 396.74769

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C=CC=C(C2=NC(=C1O)NC3=CC=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

COC(=O)C1=C2C=CC=C(C2=NC(=C1O)NC3=CC=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C18H12ClF3N2O3/c1-27-17(26)13-11-3-2-4-12(18(20,21)22)14(11)24-16(15(13)25)23-10-7-5-9(19)6-8-10/h2-8,25H,1H3,(H,23,24)