methyl 4-(5-chloranyl-2-oxidanyl-phenyl)-2-oxidanylidene-6-(trifluoromethyl)-1H-quinoline-3-carboxylate

Systemtic Name: methyl 4-(5-chloranyl-2-oxidanyl-phenyl)-2-oxidanylidene-6-(trifluoromethyl)-1H-quinoline-3-carboxylate Openeye Name: methyl 4-(5-chloro-2-hydroxy-phenyl)-2-oxo-6-(trifluoromethyl)-1H-quinoline-3-carboxylate CAS Name: 4-(5-chloro-2-hydroxyphenyl)-2-oxo-6-(trifluoromethyl)-1H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(5-chloro-2-hydroxyphenyl)-2-oxo-6-(trifluoromethyl)-1H-quinoline-3-carboxylate Traditional Name: 4-(5-chloro-2-hydroxy-phenyl)-2-keto-6-(trifluoromethyl)-1H-quinoline-3-carboxylic acid methyl ester Formula: C18H11ClF3NO4 MolecularWeight: 397.73245

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C=CC(=C2)C(F)(F)F)NC1=O)C3=C(C=CC(=C3)Cl)O

Isomeric SMILES

COC(=O)C1=C(C2=C(C=CC(=C2)C(F)(F)F)NC1=O)C3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C18H11ClF3NO4/c1-27-17(26)15-14(11-7-9(19)3-5-13(11)24)10-6-8(18(20,21)22)2-4-12(10)23-16(15)25/h2-7,24H,1H3,(H,23,25)