(5-ethanoyl-2-ethoxy-phenyl)methyl 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 2-[methyl(p-tolylsulfonyl)amino]acetate CAS Name: 2-[methyl-(4-methylphenyl)sulfonylamino]acetic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[methyl(tosyl)amino]acetic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H25NO6S/c1-5-27-20-11-8-17(16(3)23)12-18(20)14-28-21(24)13-22(4)29(25,26)19-9-6-15(2)7-10-19/h6-12H,5,13-14H2,1-4H3