[2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl] 3-(4-fluorophenyl)sulfonylpropanoate

Systemtic Name: [2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl] 3-(4-fluorophenyl)sulfonylpropanoate Openeye Name: [2-(N-isopropylanilino)-2-oxo-ethyl] 3-(4-fluorophenyl)sulfonylpropanoate CAS Name: 3-(4-fluorophenyl)sulfonylpropanoic acid [2-oxo-2-(N-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(N-propan-2-ylanilino)ethyl] 3-(4-fluorophenyl)sulfonylpropanoate Traditional Name: 3-(4-fluorophenyl)sulfonylpropionic acid [2-(N-isopropylanilino)-2-keto-ethyl] ester Formula: C20H22FNO5S MolecularWeight: 407.455783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C20H22FNO5S/c1-15(2)22(17-6-4-3-5-7-17)19(23)14-27-20(24)12-13-28(25,26)18-10-8-16(21)9-11-18/h3-11,15H,12-14H2,1-2H3