phenyl 4-(ethoxysulfonylamino)-3-[3-(2-hydroxyphenyl)piperazin-1-yl]benzenesulfonate

Systemtic Name: phenyl 4-(ethoxysulfonylamino)-3-[3-(2-hydroxyphenyl)piperazin-1-yl]benzenesulfonate Openeye Name: phenyl 4-(ethoxysulfonylamino)-3-[3-(2-hydroxyphenyl)piperazin-1-yl]benzenesulfonate CAS Name: 4-(ethoxysulfonylamino)-3-[3-(2-hydroxyphenyl)-1-piperazinyl]benzenesulfonic acid phenyl ester IUPAC Name: phenyl 4-(ethoxysulfonylamino)-3-[3-(2-hydroxyphenyl)piperazin-1-yl]benzenesulfonate Traditional Name: 4-(ethoxysulfonylamino)-3-[3-(2-hydroxyphenyl)piperazino]benzenesulfonic acid phenyl ester Formula: C24H27N3O7S2 MolecularWeight: 533.61708

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)NC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)C4=CC=CC=C4O

Isomeric SMILES

CCOS(=O)(=O)NC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)C4=CC=CC=C4O

InChI

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