1,3-benzodioxol-5-yl 2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoate

Systemtic Name: 1,3-benzodioxol-5-yl 2-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenoxy]ethanoate Openeye Name: 1,3-benzodioxol-5-yl 2-[4-[methyl(p-tolylsulfonyl)amino]phenoxy]acetate CAS Name: 2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]acetate Traditional Name: 2-[4-[methyl(tosyl)amino]phenoxy]acetic acid 1,3-benzodioxol-5-yl ester Formula: C23H21NO7S MolecularWeight: 455.48034

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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)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H21NO7S/c1-16-3-10-20(11-4-16)32(26,27)24(2)17-5-7-18(8-6-17)28-14-23(25)31-19-9-12-21-22(13-19)30-15-29-21/h3-13H,14-15H2,1-2H3