tert-butyl 4-[3-(phenylsulfonylamino)phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(phenylsulfonylamino)phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(benzenesulfonamido)benzoyl]piperazine-1-carboxylate CAS Name: 4-[[3-(benzenesulfonamido)phenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(benzenesulfonamido)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(benzenesulfonamido)benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O5S/c1-22(2,3)30-21(27)25-14-12-24(13-15-25)20(26)17-8-7-9-18(16-17)23-31(28,29)19-10-5-4-6-11-19/h4-11,16,23H,12-15H2,1-3H3