3-[4-(1-benzofuran-2-yl)phenyl]sulfonyl-2-methyl-propanoic acid

Systemtic Name: 3-[4-(1-benzofuran-2-yl)phenyl]sulfonyl-2-methyl-propanoic acid Openeye Name: 3-[4-(benzofuran-2-yl)phenyl]sulfonyl-2-methyl-propanoic acid CAS Name: 3-[4-(2-benzofuranyl)phenyl]sulfonyl-2-methylpropanoic acid IUPAC Name: 3-[4-(1-benzofuran-2-yl)phenyl]sulfonyl-2-methylpropanoic acid Traditional Name: 3-[4-(benzofuran-2-yl)phenyl]sulfonyl-2-methyl-propionic acid Formula: C18H16O5S MolecularWeight: 344.38164

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)C1=CC=C(C=C1)C2=CC3=CC=CC=C3O2)C(=O)O

Isomeric SMILES

CC(CS(=O)(=O)C1=CC=C(C=C1)C2=CC3=CC=CC=C3O2)C(=O)O

InChI

InChI=1S/C18H16O5S/c1-12(18(19)20)11-24(21,22)15-8-6-13(7-9-15)17-10-14-4-2-3-5-16(14)23-17/h2-10,12H,11H2,1H3,(H,19,20)