4-[2-(4-methylphenoxy)ethoxy]-2-sulfonyl-butanoic acid

Systemtic Name: 4-[2-(4-methylphenoxy)ethoxy]-2-sulfonyl-butanoic acid Openeye Name: 4-[2-(4-methylphenoxy)ethoxy]-2-sulfonyl-butanoic acid CAS Name: 4-[2-(4-methylphenoxy)ethoxy]-2-sulfonylbutanoic acid IUPAC Name: 4-[2-(4-methylphenoxy)ethoxy]-2-sulfonylbutanoic acid Traditional Name: 4-[2-(4-methylphenoxy)ethoxy]-2-sulfonyl-butyric acid Formula: C13H16O6S MolecularWeight: 300.32754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCOCCC(=S(=O)=O)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)OCCOCCC(=S(=O)=O)C(=O)O

InChI

InChI=1S/C13H16O6S/c1-10-2-4-11(5-3-10)19-9-8-18-7-6-12(13(14)15)20(16)17/h2-5H,6-9H2,1H3,(H,14,15)