ethanedioic acid; 3-[2-[2-(5-fluoranyl-2-methoxy-phenoxy)ethylamino]propyl]-4-methoxy-benzenesulfonamide

Systemtic Name: ethanedioic acid; 3-[2-[2-(5-fluoranyl-2-methoxy-phenoxy)ethylamino]propyl]-4-methoxy-benzenesulfonamide Openeye Name: 3-[2-[2-(5-fluoro-2-methoxy-phenoxy)ethylamino]propyl]-4-methoxy-benzenesulfonamide; oxalic acid CAS Name: 3-[2-[2-(5-fluoro-2-methoxyphenoxy)ethylamino]propyl]-4-methoxybenzenesulfonamide; oxalic acid IUPAC Name: 3-[2-[2-(5-fluoro-2-methoxyphenoxy)ethylamino]propyl]-4-methoxybenzenesulfonamide; oxalic acid Traditional Name: 3-[2-[2-(5-fluoro-2-methoxy-phenoxy)ethylamino]propyl]-4-methoxy-benzenesulfonamide; oxalic acid Formula: C21H27FN2O9S MolecularWeight: 502.510483

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C=CC(=C1)S(=O)(=O)N)OC)NCCOC2=C(C=CC(=C2)F)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CC1=C(C=CC(=C1)S(=O)(=O)N)OC)NCCOC2=C(C=CC(=C2)F)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H25FN2O5S.C2H2O4/c1-13(10-14-11-16(28(21,23)24)5-7-17(14)25-2)22-8-9-27-19-12-15(20)4-6-18(19)26-3;3-1(4)2(5)6/h4-7,11-13,22H,8-10H2,1-3H3,(H2,21,23,24);(H,3,4)(H,5,6)