phenyl 4-[2-(ethoxysulfonylamino)-5-(2-hydroxyphenyl)phenyl]piperazine-2-sulfonate

Systemtic Name: phenyl 4-[2-(ethoxysulfonylamino)-5-(2-hydroxyphenyl)phenyl]piperazine-2-sulfonate Openeye Name: phenyl 4-[2-(ethoxysulfonylamino)-5-(2-hydroxyphenyl)phenyl]piperazine-2-sulfonate CAS Name: 4-[2-(ethoxysulfonylamino)-5-(2-hydroxyphenyl)phenyl]-2-piperazinesulfonic acid phenyl ester IUPAC Name: phenyl 4-[2-(ethoxysulfonylamino)-5-(2-hydroxyphenyl)phenyl]piperazine-2-sulfonate Traditional Name: 4-[2-(ethoxysulfonylamino)-5-(2-hydroxyphenyl)phenyl]piperazine-2-sulfonic acid phenyl ester Formula: C24H27N3O7S2 MolecularWeight: 533.61708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)NC1=C(C=C(C=C1)C2=CC=CC=C2O)N3CCNC(C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CCOS(=O)(=O)NC1=C(C=C(C=C1)C2=CC=CC=C2O)N3CCNC(C3)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O7S2/c1-2-33-36(31,32)26-21-13-12-18(20-10-6-7-11-23(20)28)16-22(21)27-15-14-25-24(17-27)35(29,30)34-19-8-4-3-5-9-19/h3-13,16,24-26,28H,2,14-15,17H2,1H3