[2-[[4-(4-methylphenoxy)phenyl]amino]-2-oxidanylidene-ethyl] 2-fluoranyl-5-sulfamoyl-benzoate

Systemtic Name: [2-[[4-(4-methylphenoxy)phenyl]amino]-2-oxidanylidene-ethyl] 2-fluoranyl-5-sulfamoyl-benzoate Openeye Name: [2-[4-(4-methylphenoxy)anilino]-2-oxo-ethyl] 2-fluoro-5-sulfamoyl-benzoate CAS Name: 2-fluoro-5-sulfamoylbenzoic acid [2-[4-(4-methylphenoxy)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-methylphenoxy)anilino]-2-oxoethyl] 2-fluoro-5-sulfamoylbenzoate Traditional Name: 2-fluoro-5-sulfamoyl-benzoic acid [2-keto-2-[4-(4-methylphenoxy)anilino]ethyl] ester Formula: C22H19FN2O6S MolecularWeight: 458.459463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)F

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)F

InChI

InChI=1S/C22H19FN2O6S/c1-14-2-6-16(7-3-14)31-17-8-4-15(5-9-17)25-21(26)13-30-22(27)19-12-18(32(24,28)29)10-11-20(19)23/h2-12H,13H2,1H3,(H,25,26)(H2,24,28,29)