5-[2-[2-(2-butoxy-5-fluoranyl-phenoxy)ethylamino]propyl]-2-methoxy-benzenesulfonamide

Systemtic Name: 5-[2-[2-(2-butoxy-5-fluoranyl-phenoxy)ethylamino]propyl]-2-methoxy-benzenesulfonamide Openeye Name: 5-[2-[2-(2-butoxy-5-fluoro-phenoxy)ethylamino]propyl]-2-methoxy-benzenesulfonamide CAS Name: 5-[2-[2-(2-butoxy-5-fluorophenoxy)ethylamino]propyl]-2-methoxybenzenesulfonamide IUPAC Name: 5-[2-[2-(2-butoxy-5-fluorophenoxy)ethylamino]propyl]-2-methoxybenzenesulfonamide Traditional Name: 5-[2-[2-(2-butoxy-5-fluoro-phenoxy)ethylamino]propyl]-2-methoxy-benzenesulfonamide Formula: C22H31FN2O5S MolecularWeight: 454.555343

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)F)OCCNC(C)CC2=CC(=C(C=C2)OC)S(=O)(=O)N

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)F)OCCNC(C)CC2=CC(=C(C=C2)OC)S(=O)(=O)N

InChI

InChI=1S/C22H31FN2O5S/c1-4-5-11-29-19-9-7-18(23)15-21(19)30-12-10-25-16(2)13-17-6-8-20(28-3)22(14-17)31(24,26)27/h6-9,14-16,25H,4-5,10-13H2,1-3H3,(H2,24,26,27)