diethyl 3-methyl-5-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoyloxymethyl]-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoyloxymethyl]-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-[methyl(p-tolylsulfonyl)amino]acetyl]oxymethyl]-1H-pyrrole-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[methyl-(4-methylphenyl)sulfonylamino]-1-oxoethoxy]methyl]-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]oxymethyl]-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-[methyl(tosyl)amino]acetyl]oxymethyl]-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C22H28N2O8S MolecularWeight: 480.53132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)COC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)COC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H28N2O8S/c1-6-30-21(26)19-15(4)20(22(27)31-7-2)23-17(19)13-32-18(25)12-24(5)33(28,29)16-10-8-14(3)9-11-16/h8-11,23H,6-7,12-13H2,1-5H3