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

Systemtic Name: (4-fluorophenyl)methyl 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate Openeye Name: (4-fluorophenyl)methyl 4-[methyl(p-tolylsulfonyl)amino]benzoate CAS Name: 4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid (4-fluorophenyl)methyl ester IUPAC Name: (4-fluorophenyl)methyl 4-[methyl-(4-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[methyl(tosyl)amino]benzoic acid (4-fluorobenzyl) ester Formula: C22H20FNO4S MolecularWeight: 413.461903

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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)OCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H20FNO4S/c1-16-3-13-21(14-4-16)29(26,27)24(2)20-11-7-18(8-12-20)22(25)28-15-17-5-9-19(23)10-6-17/h3-14H,15H2,1-2H3