2-[[2-methyl-3-[2-(phenethyloxysulfinylamino)ethyl]-1-benzofuran-7-yl]oxy]ethanoic acid

Systemtic Name: 2-[[2-methyl-3-[2-(phenethyloxysulfinylamino)ethyl]-1-benzofuran-7-yl]oxy]ethanoic acid Openeye Name: 2-[2-methyl-3-[2-(phenethyloxysulfinylamino)ethyl]benzofuran-7-yl]oxyacetic acid CAS Name: 2-[[2-methyl-3-[2-(phenethyloxysulfinylamino)ethyl]-7-benzofuranyl]oxy]acetic acid IUPAC Name: 2-[[2-methyl-3-[2-(phenethyloxysulfinylamino)ethyl]-1-benzofuran-7-yl]oxy]acetic acid Traditional Name: 2-[2-methyl-3-[2-(phenethyloxysulfinylamino)ethyl]benzofuran-7-yl]oxyacetic acid Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C(=CC=C2)OCC(=O)O)CCNS(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(O1)C(=CC=C2)OCC(=O)O)CCNS(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C21H23NO6S/c1-15-17(18-8-5-9-19(21(18)28-15)26-14-20(23)24)10-12-22-29(25)27-13-11-16-6-3-2-4-7-16/h2-9,22H,10-14H2,1H3,(H,23,24)