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

Systemtic Name: 4-[2-(5-fluoranyl-2-methoxy-phenoxy)ethylamino]-2-methoxy-3-pentyl-benzenesulfonamide hydrochloride Openeye Name: 4-[2-(5-fluoro-2-methoxy-phenoxy)ethylamino]-2-methoxy-3-pentyl-benzenesulfonamide hydrochloride CAS Name: 4-[2-(5-fluoro-2-methoxyphenoxy)ethylamino]-2-methoxy-3-pentylbenzenesulfonamide hydrochloride IUPAC Name: 4-[2-(5-fluoro-2-methoxyphenoxy)ethylamino]-2-methoxy-3-pentylbenzenesulfonamide hydrochloride Traditional Name: 3-amyl-4-[2-(5-fluoro-2-methoxy-phenoxy)ethylamino]-2-methoxy-benzenesulfonamide hydrochloride Formula: C21H30ClFN2O5S MolecularWeight: 476.989703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=CC(=C1OC)S(=O)(=O)N)NCCOC2=C(C=CC(=C2)F)OC.Cl

Isomeric SMILES

CCCCCC1=C(C=CC(=C1OC)S(=O)(=O)N)NCCOC2=C(C=CC(=C2)F)OC.Cl

InChI

InChI=1S/C21H29FN2O5S.ClH/c1-4-5-6-7-16-17(9-11-20(21(16)28-3)30(23,25)26)24-12-13-29-19-14-15(22)8-10-18(19)27-2;/h8-11,14,24H,4-7,12-13H2,1-3H3,(H2,23,25,26);1H