(3-fluorophenyl) 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate

Systemtic Name: (3-fluorophenyl) 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate Openeye Name: (3-fluorophenyl) 4-[methyl(p-tolylsulfonyl)amino]benzoate CAS Name: 4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid (3-fluorophenyl) ester IUPAC Name: (3-fluorophenyl) 4-[methyl-(4-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[methyl(tosyl)amino]benzoic acid (3-fluorophenyl) ester Formula: C21H18FNO4S MolecularWeight: 399.435323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)OC3=CC(=CC=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)OC3=CC(=CC=C3)F

InChI

InChI=1S/C21H18FNO4S/c1-15-6-12-20(13-7-15)28(25,26)23(2)18-10-8-16(9-11-18)21(24)27-19-5-3-4-17(22)14-19/h3-14H,1-2H3