ethyl 4-[(2-nitro-4-oxidanyl-phenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(2-nitro-4-oxidanyl-phenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-(4-hydroxy-2-nitro-anilino)-7-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(4-hydroxy-2-nitroanilino)-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-hydroxy-2-nitroanilino)-7-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(4-hydroxy-2-nitro-anilino)-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C19H14F3N3O5 MolecularWeight: 421.32677

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=C(C=CC2=C1NC3=C(C=C(C=C3)O)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CN=C2C=C(C=CC2=C1NC3=C(C=C(C=C3)O)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C19H14F3N3O5/c1-2-30-18(27)13-9-23-15-7-10(19(20,21)22)3-5-12(15)17(13)24-14-6-4-11(26)8-16(14)25(28)29/h3-9,26H,2H2,1H3,(H,23,24)