5-(3-methylsulfonylphenoxy)pentanoic acid

Systemtic Name: 5-(3-methylsulfonylphenoxy)pentanoic acid Openeye Name: 5-(3-methylsulfonylphenoxy)pentanoic acid CAS Name: 5-(3-methylsulfonylphenoxy)pentanoic acid IUPAC Name: 5-(3-methylsulfonylphenoxy)pentanoic acid Traditional Name: 5-(3-mesylphenoxy)valeric acid Formula: C12H16O5S MolecularWeight: 272.31744

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)OCCCCC(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)OCCCCC(=O)O

InChI

InChI=1S/C12H16O5S/c1-18(15,16)11-6-4-5-10(9-11)17-8-3-2-7-12(13)14/h4-6,9H,2-3,7-8H2,1H3,(H,13,14)