2-[3-methyl-4-(3-morpholin-4-ylsulfonyl-4-oxidanyl-phenoxy)-5-(trifluoromethyl)phenoxy]ethanoic acid

Systemtic Name: 2-[3-methyl-4-(3-morpholin-4-ylsulfonyl-4-oxidanyl-phenoxy)-5-(trifluoromethyl)phenoxy]ethanoic acid Openeye Name: 2-[4-(4-hydroxy-3-morpholinosulfonyl-phenoxy)-3-methyl-5-(trifluoromethyl)phenoxy]acetic acid CAS Name: 2-[4-[4-hydroxy-3-(4-morpholinylsulfonyl)phenoxy]-3-methyl-5-(trifluoromethyl)phenoxy]acetic acid IUPAC Name: 2-[4-(4-hydroxy-3-morpholin-4-ylsulfonylphenoxy)-3-methyl-5-(trifluoromethyl)phenoxy]acetic acid Traditional Name: 2-[4-(4-hydroxy-3-morpholinosulfonyl-phenoxy)-3-methyl-5-(trifluoromethyl)phenoxy]acetic acid Formula: C20H20F3NO8S MolecularWeight: 491.43491

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)S(=O)(=O)N3CCOCC3)C(F)(F)F)OCC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)S(=O)(=O)N3CCOCC3)C(F)(F)F)OCC(=O)O

InChI

InChI=1S/C20H20F3NO8S/c1-12-8-14(31-11-18(26)27)9-15(20(21,22)23)19(12)32-13-2-3-16(25)17(10-13)33(28,29)24-4-6-30-7-5-24/h2-3,8-10,25H,4-7,11H2,1H3,(H,26,27)