dimethyl 5-[4-(tert-butylsulfamoyl)-2-nitro-phenoxy]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[4-(tert-butylsulfamoyl)-2-nitro-phenoxy]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[4-(tert-butylsulfamoyl)-2-nitro-phenoxy]benzene-1,3-dicarboxylate CAS Name: 5-[4-(tert-butylsulfamoyl)-2-nitrophenoxy]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[4-(tert-butylsulfamoyl)-2-nitrophenoxy]benzene-1,3-dicarboxylate Traditional Name: 5-[4-(tert-butylsulfamoyl)-2-nitro-phenoxy]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H22N2O9S MolecularWeight: 466.46168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O9S/c1-20(2,3)21-32(27,28)15-6-7-17(16(11-15)22(25)26)31-14-9-12(18(23)29-4)8-13(10-14)19(24)30-5/h6-11,21H,1-5H3