(E)-3-[2-(5-methylsulfonyloxypentoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(5-methylsulfonyloxypentoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-(5-methylsulfonyloxypentoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-(5-methylsulfonyloxypentoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(5-methylsulfonyloxypentoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-(5-methylsulfonyloxypentoxy)phenyl]acrylic acid Formula: C15H20O6S MolecularWeight: 328.3807

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCCCCOC1=CC=CC=C1C=CC(=O)O

Isomeric SMILES

CS(=O)(=O)OCCCCCOC1=CC=CC=C1/C=C/C(=O)O

InChI

InChI=1S/C15H20O6S/c1-22(18,19)21-12-6-2-5-11-20-14-8-4-3-7-13(14)9-10-15(16)17/h3-4,7-10H,2,5-6,11-12H2,1H3,(H,16,17)/b10-9+