[2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl] 2-(4-fluorophenyl)quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl] 2-(4-fluorophenyl)quinoline-4-carboxylate Openeye Name: [2-(3-isopropoxypropylamino)-2-oxo-ethyl] 2-(4-fluorophenyl)quinoline-4-carboxylate CAS Name: 2-(4-fluorophenyl)-4-quinolinecarboxylic acid [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] 2-(4-fluorophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-fluorophenyl)cinchoninic acid [2-(3-isopropoxypropylamino)-2-keto-ethyl] ester Formula: C24H25FN2O4 MolecularWeight: 424.464703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)OCCCNC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H25FN2O4/c1-16(2)30-13-5-12-26-23(28)15-31-24(29)20-14-22(17-8-10-18(25)11-9-17)27-21-7-4-3-6-19(20)21/h3-4,6-11,14,16H,5,12-13,15H2,1-2H3,(H,26,28)