1-[5-(2-methylpropyl)-2-(phenoxysulfonylsulfonylamino)phenyl]-3-oxidanyl-piperazine

Systemtic Name: 1-[5-(2-methylpropyl)-2-(phenoxysulfonylsulfonylamino)phenyl]-3-oxidanyl-piperazine Openeye Name: 3-hydroxy-1-[5-isobutyl-2-(phenoxysulfonylsulfonylamino)phenyl]piperazine CAS Name: 3-hydroxy-1-[5-(2-methylpropyl)-2-(phenoxysulfonylsulfonylamino)phenyl]piperazine IUPAC Name: 3-hydroxy-1-[5-(2-methylpropyl)-2-(phenoxysulfonylsulfonylamino)phenyl]piperazine Traditional Name: 3-hydroxy-1-[5-isobutyl-2-(phenoxysulfonylsulfonylamino)phenyl]piperazine Formula: C20H27N3O6S2 MolecularWeight: 469.57488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)O

Isomeric SMILES

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)O

InChI

InChI=1S/C20H27N3O6S2/c1-15(2)12-16-8-9-18(19(13-16)23-11-10-21-20(24)14-23)22-30(25,26)31(27,28)29-17-6-4-3-5-7-17/h3-9,13,15,20-22,24H,10-12,14H2,1-2H3