tert-butyl 4-[2,6-diaminocarbonyl-4-(2-sulfamoylethanoyloxy)phenoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2,6-diaminocarbonyl-4-(2-sulfamoylethanoyloxy)phenoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2,6-dicarbamoyl-4-(2-sulfamoylacetyl)oxy-phenoxy]piperidine-1-carboxylate CAS Name: 4-[2,6-dicarbamoyl-4-(1-oxo-2-sulfamoylethoxy)phenoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2,6-dicarbamoyl-4-(2-sulfamoylacetyl)oxyphenoxy]piperidine-1-carboxylate Traditional Name: 4-[2,6-dicarbamoyl-4-(2-sulfamoylacetyl)oxy-phenoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H28N4O9S MolecularWeight: 500.52272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OC2=C(C=C(C=C2C(=O)N)OC(=O)CS(=O)(=O)N)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OC2=C(C=C(C=C2C(=O)N)OC(=O)CS(=O)(=O)N)C(=O)N

InChI

InChI=1S/C20H28N4O9S/c1-20(2,3)33-19(28)24-6-4-11(5-7-24)32-16-13(17(21)26)8-12(9-14(16)18(22)27)31-15(25)10-34(23,29)30/h8-9,11H,4-7,10H2,1-3H3,(H2,21,26)(H2,22,27)(H2,23,29,30)