1-[2-(2,5-dimethoxy-4-methylsulfinyl-phenoxy)ethylamino]-3-(2-methylphenoxy)propan-2-ol; ethanedioic acid

Systemtic Name: 1-[2-(2,5-dimethoxy-4-methylsulfinyl-phenoxy)ethylamino]-3-(2-methylphenoxy)propan-2-ol; ethanedioic acid Openeye Name: 1-[2-(2,5-dimethoxy-4-methylsulfinyl-phenoxy)ethylamino]-3-(2-methylphenoxy)propan-2-ol; oxalic acid CAS Name: 1-[2-(2,5-dimethoxy-4-methylsulfinylphenoxy)ethylamino]-3-(2-methylphenoxy)-2-propanol; oxalic acid IUPAC Name: 1-[2-(2,5-dimethoxy-4-methylsulfinylphenoxy)ethylamino]-3-(2-methylphenoxy)propan-2-ol; oxalic acid Traditional Name: 1-[2-(2,5-dimethoxy-4-methylsulfinyl-phenoxy)ethylamino]-3-(2-methylphenoxy)propan-2-ol; oxalic acid Formula: C23H31NO10S MolecularWeight: 513.55794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(CNCCOC2=CC(=C(C=C2OC)S(=O)C)OC)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1OCC(CNCCOC2=CC(=C(C=C2OC)S(=O)C)OC)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H29NO6S.C2H2O4/c1-15-7-5-6-8-17(15)28-14-16(23)13-22-9-10-27-19-11-20(26-3)21(29(4)24)12-18(19)25-2;3-1(4)2(5)6/h5-8,11-12,16,22-23H,9-10,13-14H2,1-4H3;(H,3,4)(H,5,6)