2-(2-methylsulfonyl-1,3-dihydroisoindol-5-yl)ethanoic acid

Systemtic Name: 2-(2-methylsulfonyl-1,3-dihydroisoindol-5-yl)ethanoic acid Openeye Name: 2-(2-methylsulfonylisoindolin-5-yl)acetic acid CAS Name: 2-(2-methylsulfonyl-1,3-dihydroisoindol-5-yl)acetic acid IUPAC Name: 2-(2-methylsulfonyl-1,3-dihydroisoindol-5-yl)acetic acid Traditional Name: 2-(2-mesylisoindolin-5-yl)acetic acid Formula: C11H13NO4S MolecularWeight: 255.29022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC2=C(C1)C=C(C=C2)CC(=O)O

Isomeric SMILES

CS(=O)(=O)N1CC2=C(C1)C=C(C=C2)CC(=O)O

InChI

InChI=1S/C11H13NO4S/c1-17(15,16)12-6-9-3-2-8(5-11(13)14)4-10(9)7-12/h2-4H,5-7H2,1H3,(H,13,14)