(2S)-2-[4-(phenylmethyl)sulfonyloxyphenyl]propanoic acid

Systemtic Name: (2S)-2-[4-(phenylmethyl)sulfonyloxyphenyl]propanoic acid Openeye Name: (2S)-2-(4-benzylsulfonyloxyphenyl)propanoic acid CAS Name: (2S)-2-[4-(phenylmethyl)sulfonyloxyphenyl]propanoic acid IUPAC Name: (2S)-2-(4-benzylsulfonyloxyphenyl)propanoic acid Traditional Name: (2S)-2-(4-benzylsulfonyloxyphenyl)propionic acid Formula: C16H16O5S MolecularWeight: 320.36024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OS(=O)(=O)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)OS(=O)(=O)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H16O5S/c1-12(16(17)18)14-7-9-15(10-8-14)21-22(19,20)11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H,17,18)/t12-/m0/s1