tert-butyl 4-(4-methoxyphenyl)sulfonyl-3-(oxidanylcarbamoyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-methoxyphenyl)sulfonyl-3-(oxidanylcarbamoyl)piperazine-1-carboxylate Openeye Name: tert-butyl 3-(hydroxycarbamoyl)-4-(4-methoxyphenyl)sulfonyl-piperazine-1-carboxylate CAS Name: 3-[(hydroxyamino)-oxomethyl]-4-(4-methoxyphenyl)sulfonyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(hydroxycarbamoyl)-4-(4-methoxyphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 3-(hydroxycarbamoyl)-4-(4-methoxyphenyl)sulfonyl-piperazine-1-carboxylic acid tert-butyl ester Formula: C17H25N3O7S MolecularWeight: 415.4613

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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)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(C1)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C17H25N3O7S/c1-17(2,3)27-16(22)19-9-10-20(14(11-19)15(21)18-23)28(24,25)13-7-5-12(26-4)6-8-13/h5-8,14,23H,9-11H2,1-4H3,(H,18,21)