2-[5-methoxy-6-[[5-(3-methylsulfonyloxyphenyl)-1,2-oxazol-3-yl]methoxy]-1-benzofuran-3-yl]ethanoic acid

Systemtic Name: 2-[5-methoxy-6-[[5-(3-methylsulfonyloxyphenyl)-1,2-oxazol-3-yl]methoxy]-1-benzofuran-3-yl]ethanoic acid Openeye Name: 2-[5-methoxy-6-[[5-(3-methylsulfonyloxyphenyl)isoxazol-3-yl]methoxy]benzofuran-3-yl]acetic acid CAS Name: 2-[5-methoxy-6-[[5-(3-methylsulfonyloxyphenyl)-3-isoxazolyl]methoxy]-3-benzofuranyl]acetic acid IUPAC Name: 2-[5-methoxy-6-[[5-(3-methylsulfonyloxyphenyl)-1,2-oxazol-3-yl]methoxy]-1-benzofuran-3-yl]acetic acid Traditional Name: 2-[5-methoxy-6-[[5-(3-methylsulfonyloxyphenyl)isoxazol-3-yl]methoxy]benzofuran-3-yl]acetic acid Formula: C22H19NO9S MolecularWeight: 473.45256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=CO2)CC(=O)O)OCC3=NOC(=C3)C4=CC(=CC=C4)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=CO2)CC(=O)O)OCC3=NOC(=C3)C4=CC(=CC=C4)OS(=O)(=O)C

InChI

InChI=1S/C22H19NO9S/c1-28-20-9-17-14(7-22(24)25)11-29-19(17)10-21(20)30-12-15-8-18(31-23-15)13-4-3-5-16(6-13)32-33(2,26)27/h3-6,8-11H,7,12H2,1-2H3,(H,24,25)