dimethyl 5-[2-(4-methylsulfonylphenyl)carbonyloxyethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(4-methylsulfonylphenyl)carbonyloxyethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(4-methylsulfonylbenzoyl)oxyacetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[(4-methylsulfonylphenyl)-oxomethoxy]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(4-methylsulfonylbenzoyl)oxyacetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(4-mesylbenzoyl)oxyacetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H19NO9S MolecularWeight: 449.43116

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)C)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C20H19NO9S/c1-28-18(23)13-8-14(19(24)29-2)10-15(9-13)21-17(22)11-30-20(25)12-4-6-16(7-5-12)31(3,26)27/h4-10H,11H2,1-3H3,(H,21,22)