2-(4-hexylsulfonylphenyl)ethanoic acid

Systemtic Name: 2-(4-hexylsulfonylphenyl)ethanoic acid Openeye Name: 2-(4-hexylsulfonylphenyl)acetic acid CAS Name: 2-(4-hexylsulfonylphenyl)acetic acid IUPAC Name: 2-(4-hexylsulfonylphenyl)acetic acid Traditional Name: 2-(4-hexylsulfonylphenyl)acetic acid Formula: C14H20O4S MolecularWeight: 284.3712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)C1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CCCCCCS(=O)(=O)C1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C14H20O4S/c1-2-3-4-5-10-19(17,18)13-8-6-12(7-9-13)11-14(15)16/h6-9H,2-5,10-11H2,1H3,(H,15,16)