2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfonyl]ethanoic acid

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfonyl]ethanoic acid Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfonyl]acetic acid CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfonyl]acetic acid IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfonyl]acetic acid Traditional Name: 2-(3-fluoro-4-methoxy-benzyl)sulfonylacetic acid Formula: C10H11FO5S MolecularWeight: 262.254743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CS(=O)(=O)CC(=O)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)CS(=O)(=O)CC(=O)O)F

InChI

InChI=1S/C10H11FO5S/c1-16-9-3-2-7(4-8(9)11)5-17(14,15)6-10(12)13/h2-4H,5-6H2,1H3,(H,12,13)