5-(4-methylphenyl)sulfonyl-3-oxidanyl-pentanoic acid

Systemtic Name: 5-(4-methylphenyl)sulfonyl-3-oxidanyl-pentanoic acid Openeye Name: 3-hydroxy-5-(p-tolylsulfonyl)pentanoic acid CAS Name: 3-hydroxy-5-(4-methylphenyl)sulfonylpentanoic acid IUPAC Name: 3-hydroxy-5-(4-methylphenyl)sulfonylpentanoic acid Traditional Name: 3-hydroxy-5-tosyl-valeric acid Formula: C12H16O5S MolecularWeight: 272.31744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(CC(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(CC(=O)O)O

InChI

InChI=1S/C12H16O5S/c1-9-2-4-11(5-3-9)18(16,17)7-6-10(13)8-12(14)15/h2-5,10,13H,6-8H2,1H3,(H,14,15)