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

Systemtic Name: 1-[5-ethyl-2-(phenoxysulfonylsulfonylamino)phenyl]-3-oxidanyl-piperazine Openeye Name: 1-[5-ethyl-2-(phenoxysulfonylsulfonylamino)phenyl]-3-hydroxy-piperazine CAS Name: 1-[5-ethyl-2-(phenoxysulfonylsulfonylamino)phenyl]-3-hydroxypiperazine IUPAC Name: 1-[5-ethyl-2-(phenoxysulfonylsulfonylamino)phenyl]-3-hydroxypiperazine Traditional Name: 1-[5-ethyl-2-(phenoxysulfonylsulfonylamino)phenyl]-3-hydroxy-piperazine Formula: C18H23N3O6S2 MolecularWeight: 441.52172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)O

Isomeric SMILES

CCC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)O

InChI

InChI=1S/C18H23N3O6S2/c1-2-14-8-9-16(17(12-14)21-11-10-19-18(22)13-21)20-28(23,24)29(25,26)27-15-6-4-3-5-7-15/h3-9,12,18-20,22H,2,10-11,13H2,1H3