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

Systemtic Name: phenyl 4-[2-(chloranylsulfonylamino)-5-phenyl-phenyl]piperazine-2-sulfonate Openeye Name: phenyl 4-[2-(chlorosulfonylamino)-5-phenyl-phenyl]piperazine-2-sulfonate CAS Name: 4-[2-(chlorosulfonylamino)-5-phenylphenyl]-2-piperazinesulfonic acid phenyl ester IUPAC Name: phenyl 4-[2-(chlorosulfonylamino)-5-phenylphenyl]piperazine-2-sulfonate Traditional Name: 4-[2-(chlorosulfonylamino)-5-phenyl-phenyl]piperazine-2-sulfonic acid phenyl ester Formula: C22H22ClN3O5S2 MolecularWeight: 508.01018

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClN3O5S2/c23-33(29,30)25-20-12-11-18(17-7-3-1-4-8-17)15-21(20)26-14-13-24-22(16-26)32(27,28)31-19-9-5-2-6-10-19/h1-12,15,22,24-25H,13-14,16H2