3-ethoxy-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine

Systemtic Name: 3-ethoxy-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine Openeye Name: 3-ethoxy-1-[2-(isopropylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine CAS Name: 3-ethoxy-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propylphenyl]piperazine IUPAC Name: 3-ethoxy-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propylphenyl]piperazine Traditional Name: 3-ethoxy-1-[2-(isopropylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine Formula: C18H31N3O5S2 MolecularWeight: 433.58584

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)C(C)C)N2CCNC(C2)OCC

Isomeric SMILES

CCCC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)C(C)C)N2CCNC(C2)OCC

InChI

InChI=1S/C18H31N3O5S2/c1-5-7-15-8-9-16(20-28(24,25)27(22,23)14(3)4)17(12-15)21-11-10-19-18(13-21)26-6-2/h8-9,12,14,18-20H,5-7,10-11,13H2,1-4H3