phenyl 4-[5-phenyl-2-(phenylsulfonylsulfonylamino)phenyl]piperazine-2-sulfonate

Systemtic Name: phenyl 4-[5-phenyl-2-(phenylsulfonylsulfonylamino)phenyl]piperazine-2-sulfonate Openeye Name: phenyl 4-[2-(benzenesulfonylsulfonylamino)-5-phenyl-phenyl]piperazine-2-sulfonate CAS Name: 4-[2-(benzenesulfonylsulfonylamino)-5-phenylphenyl]-2-piperazinesulfonic acid phenyl ester IUPAC Name: phenyl 4-[2-(benzenesulfonylsulfonylamino)-5-phenylphenyl]piperazine-2-sulfonate Traditional Name: 4-[2-(besylsulfonylamino)-5-phenyl-phenyl]piperazine-2-sulfonic acid phenyl ester Formula: C28H27N3O7S3 MolecularWeight: 613.72488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)S(=O)(=O)OC2=CC=CC=C2)C3=C(C=CC(=C3)C4=CC=CC=C4)NS(=O)(=O)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC(N1)S(=O)(=O)OC2=CC=CC=C2)C3=C(C=CC(=C3)C4=CC=CC=C4)NS(=O)(=O)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H27N3O7S3/c32-39(33,38-24-12-6-2-7-13-24)28-21-31(19-18-29-28)27-20-23(22-10-4-1-5-11-22)16-17-26(27)30-41(36,37)40(34,35)25-14-8-3-9-15-25/h1-17,20,28-30H,18-19,21H2