diethyl 5-[[3-(methylsulfonylmethyl)phenyl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[[3-(methylsulfonylmethyl)phenyl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[[3-(methylsulfonylmethyl)benzoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[3-(methylsulfonylmethyl)phenyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[3-(methylsulfonylmethyl)benzoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[3-(mesylmethyl)benzoyl]amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C21H23NO7S MolecularWeight: 433.47482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC(=CC=C2)CS(=O)(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC(=CC=C2)CS(=O)(=O)C)C(=O)OCC

InChI

InChI=1S/C21H23NO7S/c1-4-28-20(24)16-10-17(21(25)29-5-2)12-18(11-16)22-19(23)15-8-6-7-14(9-15)13-30(3,26)27/h6-12H,4-5,13H2,1-3H3,(H,22,23)