ethyl 4-[(3-nitrophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(3-nitrophenyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-(3-nitroanilino)-7-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(3-nitroanilino)-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-nitroanilino)-7-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(3-nitroanilino)-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C19H14F3N3O4 MolecularWeight: 405.32737

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14F3N3O4/c1-2-29-18(26)15-10-23-16-8-11(19(20,21)22)6-7-14(16)17(15)24-12-4-3-5-13(9-12)25(27)28/h3-10H,2H2,1H3,(H,23,24)