3-(2-methylsulfinylethanoyl)-5-phenylmethoxy-benzoic acid

Systemtic Name: 3-(2-methylsulfinylethanoyl)-5-phenylmethoxy-benzoic acid Openeye Name: 3-benzyloxy-5-(2-methylsulfinylacetyl)benzoic acid CAS Name: 3-(2-methylsulfinyl-1-oxoethyl)-5-phenylmethoxybenzoic acid IUPAC Name: 3-(2-methylsulfinylacetyl)-5-phenylmethoxybenzoic acid Traditional Name: 3-benzoxy-5-(2-methylsulfinylacetyl)benzoic acid Formula: C17H16O5S MolecularWeight: 332.37094

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CC(=O)C1=CC(=CC(=C1)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CS(=O)CC(=O)C1=CC(=CC(=C1)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H16O5S/c1-23(21)11-16(18)13-7-14(17(19)20)9-15(8-13)22-10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,19,20)