[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl] 7-fluoranyl-2-methyl-quinoline-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl] 7-fluoranyl-2-methyl-quinoline-3-carboxylate Openeye Name: [2-oxo-2-(3,4,5-trimethoxyanilino)ethyl] 7-fluoro-2-methyl-quinoline-3-carboxylate CAS Name: 7-fluoro-2-methyl-3-quinolinecarboxylic acid [2-oxo-2-(3,4,5-trimethoxyanilino)ethyl] ester IUPAC Name: [2-oxo-2-(3,4,5-trimethoxyanilino)ethyl] 7-fluoro-2-methylquinoline-3-carboxylate Traditional Name: 7-fluoro-2-methyl-quinoline-3-carboxylic acid [2-keto-2-(3,4,5-trimethoxyanilino)ethyl] ester Formula: C22H21FN2O6 MolecularWeight: 428.410343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)OCC(=O)NC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)OCC(=O)NC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C22H21FN2O6/c1-12-16(7-13-5-6-14(23)8-17(13)24-12)22(27)31-11-20(26)25-15-9-18(28-2)21(30-4)19(10-15)29-3/h5-10H,11H2,1-4H3,(H,25,26)