3-[2-(4-methylphenyl)sulfonyloxyphenyl]propanoic acid

Systemtic Name: 3-[2-(4-methylphenyl)sulfonyloxyphenyl]propanoic acid Openeye Name: 3-[2-(p-tolylsulfonyloxy)phenyl]propanoic acid CAS Name: 3-[2-(4-methylphenyl)sulfonyloxyphenyl]propanoic acid IUPAC Name: 3-[2-(4-methylphenyl)sulfonyloxyphenyl]propanoic acid Traditional Name: 3-(2-tosyloxyphenyl)propionic acid Formula: C16H16O5S MolecularWeight: 320.36024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2CCC(=O)O

InChI

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