2-[6-methyl-7-(4-methylsulfonylphenyl)carbonyl-1-benzofuran-5-yl]ethanoic acid

Systemtic Name: 2-[6-methyl-7-(4-methylsulfonylphenyl)carbonyl-1-benzofuran-5-yl]ethanoic acid Openeye Name: 2-[6-methyl-7-(4-methylsulfonylbenzoyl)benzofuran-5-yl]acetic acid CAS Name: 2-[6-methyl-7-[(4-methylsulfonylphenyl)-oxomethyl]-5-benzofuranyl]acetic acid IUPAC Name: 2-[6-methyl-7-(4-methylsulfonylbenzoyl)-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[7-(4-mesylbenzoyl)-6-methyl-benzofuran-5-yl]acetic acid Formula: C19H16O6S MolecularWeight: 372.39174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=COC2=C1C(=O)C3=CC=C(C=C3)S(=O)(=O)C)CC(=O)O

Isomeric SMILES

CC1=C(C=C2C=COC2=C1C(=O)C3=CC=C(C=C3)S(=O)(=O)C)CC(=O)O

InChI

InChI=1S/C19H16O6S/c1-11-14(10-16(20)21)9-13-7-8-25-19(13)17(11)18(22)12-3-5-15(6-4-12)26(2,23)24/h3-9H,10H2,1-2H3,(H,20,21)