(3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 2-fluoranyl-5-(methylsulfamoyl)benzoate

Systemtic Name: (3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 2-fluoranyl-5-(methylsulfamoyl)benzoate Openeye Name: (3-acetyl-2,4,6-trimethyl-phenyl)methyl 2-fluoro-5-(methylsulfamoyl)benzoate CAS Name: 2-fluoro-5-(methylsulfamoyl)benzoic acid (3-acetyl-2,4,6-trimethylphenyl)methyl ester IUPAC Name: (3-acetyl-2,4,6-trimethylphenyl)methyl 2-fluoro-5-(methylsulfamoyl)benzoate Traditional Name: 2-fluoro-5-(methylsulfamoyl)benzoic acid (3-acetyl-2,4,6-trimethyl-benzyl) ester Formula: C20H22FNO5S MolecularWeight: 407.455783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC)F)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC)F)C

InChI

InChI=1S/C20H22FNO5S/c1-11-8-12(2)19(14(4)23)13(3)17(11)10-27-20(24)16-9-15(6-7-18(16)21)28(25,26)22-5/h6-9,22H,10H2,1-5H3