dimethyl 5-[2-(phenylsulfonyl)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(phenylsulfonyl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(benzenesulfonyl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(benzenesulfonyl)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(benzenesulfonyl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(2-besylacetyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H17NO7S MolecularWeight: 391.39508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO7S/c1-25-17(21)12-8-13(18(22)26-2)10-14(9-12)19-16(20)11-27(23,24)15-6-4-3-5-7-15/h3-10H,11H2,1-2H3,(H,19,20)