ethyl 4-[(2-chloranyl-4-fluoranyl-phenyl)amino]-6-ethoxy-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(2-chloranyl-4-fluoranyl-phenyl)amino]-6-ethoxy-quinoline-3-carboxylate Openeye Name: ethyl 4-(2-chloro-4-fluoro-anilino)-6-ethoxy-quinoline-3-carboxylate CAS Name: 4-(2-chloro-4-fluoroanilino)-6-ethoxy-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chloro-4-fluoroanilino)-6-ethoxyquinoline-3-carboxylate Traditional Name: 4-(2-chloro-4-fluoro-anilino)-6-ethoxy-quinoline-3-carboxylic acid ethyl ester Formula: C20H18ClFN2O3 MolecularWeight: 388.819923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C20H18ClFN2O3/c1-3-26-13-6-8-17-14(10-13)19(15(11-23-17)20(25)27-4-2)24-18-7-5-12(22)9-16(18)21/h5-11H,3-4H2,1-2H3,(H,23,24)