ethyl 6-chloranyl-4-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethoxy]quinoline-2-carboxylate

Systemtic Name: ethyl 6-chloranyl-4-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethoxy]quinoline-2-carboxylate Openeye Name: ethyl 6-chloro-4-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethoxy]quinoline-2-carboxylate CAS Name: 6-chloro-4-[2-[(4-fluorophenyl)methylamino]-2-oxoethoxy]-2-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-4-[2-[(4-fluorophenyl)methylamino]-2-oxoethoxy]quinoline-2-carboxylate Traditional Name: 6-chloro-4-[2-[(4-fluorobenzyl)amino]-2-keto-ethoxy]quinaldic acid ethyl ester Formula: C21H18ClFN2O4 MolecularWeight: 416.830023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C=C(C=C2)Cl)C(=C1)OCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NC2=C(C=C(C=C2)Cl)C(=C1)OCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H18ClFN2O4/c1-2-28-21(27)18-10-19(16-9-14(22)5-8-17(16)25-18)29-12-20(26)24-11-13-3-6-15(23)7-4-13/h3-10H,2,11-12H2,1H3,(H,24,26)