[1-oxidanylidene-1-(phenethylamino)propan-2-yl] 7-fluoranyl-2-methyl-quinoline-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-(phenethylamino)propan-2-yl] 7-fluoranyl-2-methyl-quinoline-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(phenethylamino)ethyl] 7-fluoro-2-methyl-quinoline-3-carboxylate CAS Name: 7-fluoro-2-methyl-3-quinolinecarboxylic acid [1-oxo-1-(phenethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(phenethylamino)propan-2-yl] 7-fluoro-2-methylquinoline-3-carboxylate Traditional Name: 7-fluoro-2-methyl-quinoline-3-carboxylic acid [2-keto-1-methyl-2-(phenethylamino)ethyl] ester Formula: C22H21FN2O3 MolecularWeight: 380.412143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)OC(C)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)OC(C)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H21FN2O3/c1-14-19(12-17-8-9-18(23)13-20(17)25-14)22(27)28-15(2)21(26)24-11-10-16-6-4-3-5-7-16/h3-9,12-13,15H,10-11H2,1-2H3,(H,24,26)