[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-(4-fluorophenyl)quinoline-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-(4-fluorophenyl)quinoline-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2-(4-fluorophenyl)quinoline-4-carboxylate CAS Name: 2-(4-fluorophenyl)-4-quinolinecarboxylic acid [1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-(4-fluorophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-fluorophenyl)cinchoninic acid [2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C29H26FN3O3 MolecularWeight: 483.533443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F

InChI

InChI=1S/C29H26FN3O3/c1-20(28(34)33-17-15-32(16-18-33)23-7-3-2-4-8-23)36-29(35)25-19-27(21-11-13-22(30)14-12-21)31-26-10-6-5-9-24(25)26/h2-14,19-20H,15-18H2,1H3