tert-butyl 4-(oxidanylcarbamoyl)-4-(4-phenoxyphenyl)sulfonyl-piperidine-1-carboxylate hydrochloride

Systemtic Name: tert-butyl 4-(oxidanylcarbamoyl)-4-(4-phenoxyphenyl)sulfonyl-piperidine-1-carboxylate hydrochloride Openeye Name: tert-butyl 4-(hydroxycarbamoyl)-4-(4-phenoxyphenyl)sulfonyl-piperidine-1-carboxylate hydrochloride CAS Name: 4-[(hydroxyamino)-oxomethyl]-4-(4-phenoxyphenyl)sulfonyl-1-piperidinecarboxylic acid tert-butyl ester hydrochloride IUPAC Name: tert-butyl 4-(hydroxycarbamoyl)-4-(4-phenoxyphenyl)sulfonylpiperidine-1-carboxylate hydrochloride Traditional Name: 4-(hydroxycarbamoyl)-4-(4-phenoxyphenyl)sulfonyl-piperidine-1-carboxylic acid tert-butyl ester hydrochloride Formula: C23H29ClN2O7S MolecularWeight: 513.00356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3.Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3.Cl

InChI

InChI=1S/C23H28N2O7S.ClH/c1-22(2,3)32-21(27)25-15-13-23(14-16-25,20(26)24-28)33(29,30)19-11-9-18(10-12-19)31-17-7-5-4-6-8-17;/h4-12,28H,13-16H2,1-3H3,(H,24,26);1H