tert-butyl 4-[4-(4-cyanophenoxy)phenyl]sulfonyl-3-(oxidanylcarbamoyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(4-cyanophenoxy)phenyl]sulfonyl-3-(oxidanylcarbamoyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(4-cyanophenoxy)phenyl]sulfonyl-3-(hydroxycarbamoyl)piperazine-1-carboxylate CAS Name: 4-[4-(4-cyanophenoxy)phenyl]sulfonyl-3-[(hydroxyamino)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(4-cyanophenoxy)phenyl]sulfonyl-3-(hydroxycarbamoyl)piperazine-1-carboxylate Traditional Name: 4-[4-(4-cyanophenoxy)phenyl]sulfonyl-3-(hydroxycarbamoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C23H26N4O7S MolecularWeight: 502.54014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(C1)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(C1)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H26N4O7S/c1-23(2,3)34-22(29)26-12-13-27(20(15-26)21(28)25-30)35(31,32)19-10-8-18(9-11-19)33-17-6-4-16(14-24)5-7-17/h4-11,20,30H,12-13,15H2,1-3H3,(H,25,28)