dimethyl 2-[2-(4-methylsulfanylphenyl)carbonyloxyethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-(4-methylsulfanylphenyl)carbonyloxyethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-(4-methylsulfanylbenzoyl)oxyacetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-[[4-(methylthio)phenyl]-oxomethoxy]-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-(4-methylsulfanylbenzoyl)oxyacetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-[4-(methylthio)benzoyl]oxyacetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C20H19NO7S MolecularWeight: 417.43236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19NO7S/c1-26-18(23)13-6-9-15(20(25)27-2)16(10-13)21-17(22)11-28-19(24)12-4-7-14(29-3)8-5-12/h4-10H,11H2,1-3H3,(H,21,22)