[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-(4-fluorophenyl)quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-(4-fluorophenyl)quinoline-4-carboxylate Openeye Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-(4-fluorophenyl)quinoline-4-carboxylate CAS Name: 2-(4-fluorophenyl)-4-quinolinecarboxylic acid [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-(4-fluorophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-fluorophenyl)cinchoninic acid [2-keto-2-[(4-sulfamoylbenzyl)amino]ethyl] ester Formula: C25H20FN3O5S MolecularWeight: 493.506803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)F)C(=O)OCC(=O)NCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)F)C(=O)OCC(=O)NCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C25H20FN3O5S/c26-18-9-7-17(8-10-18)23-13-21(20-3-1-2-4-22(20)29-23)25(31)34-15-24(30)28-14-16-5-11-19(12-6-16)35(27,32)33/h1-13H,14-15H2,(H,28,30)(H2,27,32,33)