[2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-quinolin-2-ylpropanoate

Systemtic Name: [2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-quinolin-2-ylpropanoate Openeye Name: [2-(4-fluoroanilino)-2-oxo-1-phenyl-ethyl] 3-(2-quinolyl)propanoate CAS Name: 3-(2-quinolinyl)propanoic acid [2-(4-fluoroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-fluoroanilino)-2-oxo-1-phenylethyl] 3-quinolin-2-ylpropanoate Traditional Name: 3-(2-quinolyl)propionic acid [2-(4-fluoroanilino)-2-keto-1-phenyl-ethyl] ester Formula: C26H21FN2O3 MolecularWeight: 428.454943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)F)OC(=O)CCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)F)OC(=O)CCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H21FN2O3/c27-20-11-14-22(15-12-20)29-26(31)25(19-7-2-1-3-8-19)32-24(30)17-16-21-13-10-18-6-4-5-9-23(18)28-21/h1-15,25H,16-17H2,(H,29,31)