(3-bromophenyl)methyl 2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoate

Systemtic Name: (3-bromophenyl)methyl 2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoate Openeye Name: (3-bromophenyl)methyl 2-[4-[methyl(p-tolylsulfonyl)amino]phenoxy]acetate CAS Name: 2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetic acid (3-bromophenyl)methyl ester IUPAC Name: (3-bromophenyl)methyl 2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetate Traditional Name: 2-[4-[methyl(tosyl)amino]phenoxy]acetic acid (3-bromobenzyl) ester Formula: C23H22BrNO5S MolecularWeight: 504.39348

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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)OCC(=O)OCC3=CC(=CC=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C23H22BrNO5S/c1-17-6-12-22(13-7-17)31(27,28)25(2)20-8-10-21(11-9-20)29-16-23(26)30-15-18-4-3-5-19(24)14-18/h3-14H,15-16H2,1-2H3