3-[5-ethanoyl-2-(5-methylsulfonyloxypentoxy)phenyl]propanoic acid

Systemtic Name: 3-[5-ethanoyl-2-(5-methylsulfonyloxypentoxy)phenyl]propanoic acid Openeye Name: 3-[5-acetyl-2-(5-methylsulfonyloxypentoxy)phenyl]propanoic acid CAS Name: 3-[5-acetyl-2-(5-methylsulfonyloxypentoxy)phenyl]propanoic acid IUPAC Name: 3-[5-acetyl-2-(5-methylsulfonyloxypentoxy)phenyl]propanoic acid Traditional Name: 3-[5-acetyl-2-(5-methylsulfonyloxypentoxy)phenyl]propionic acid Formula: C17H24O7S MolecularWeight: 372.43326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCCCCCOS(=O)(=O)C)CCC(=O)O

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCCCCCOS(=O)(=O)C)CCC(=O)O

InChI

InChI=1S/C17H24O7S/c1-13(18)14-6-8-16(15(12-14)7-9-17(19)20)23-10-4-3-5-11-24-25(2,21)22/h6,8,12H,3-5,7,9-11H2,1-2H3,(H,19,20)