4-[2-(2-butoxy-5-fluoranyl-phenoxy)ethylamino]-2-methoxy-3-propyl-benzenesulfonamide hydrochloride

Systemtic Name: 4-[2-(2-butoxy-5-fluoranyl-phenoxy)ethylamino]-2-methoxy-3-propyl-benzenesulfonamide hydrochloride Openeye Name: 4-[2-(2-butoxy-5-fluoro-phenoxy)ethylamino]-2-methoxy-3-propyl-benzenesulfonamide hydrochloride CAS Name: 4-[2-(2-butoxy-5-fluorophenoxy)ethylamino]-2-methoxy-3-propylbenzenesulfonamide hydrochloride IUPAC Name: 4-[2-(2-butoxy-5-fluorophenoxy)ethylamino]-2-methoxy-3-propylbenzenesulfonamide hydrochloride Traditional Name: 4-[2-(2-butoxy-5-fluoro-phenoxy)ethylamino]-2-methoxy-3-propyl-benzenesulfonamide hydrochloride Formula: C22H32ClFN2O5S MolecularWeight: 491.016283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)F)OCCNC2=C(C(=C(C=C2)S(=O)(=O)N)OC)CCC.Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)F)OCCNC2=C(C(=C(C=C2)S(=O)(=O)N)OC)CCC.Cl

InChI

InChI=1S/C22H31FN2O5S.ClH/c1-4-6-13-29-19-10-8-16(23)15-20(19)30-14-12-25-18-9-11-21(31(24,26)27)22(28-3)17(18)7-5-2;/h8-11,15,25H,4-7,12-14H2,1-3H3,(H2,24,26,27);1H