2-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanoic acid

Systemtic Name: 2-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanoic acid Openeye Name: 2-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetic acid CAS Name: 2-[2-methyl-4-(1-pyrrolidinylsulfonyl)phenoxy]acetic acid IUPAC Name: 2-(2-methyl-4-pyrrolidin-1-ylsulfonylphenoxy)acetic acid Traditional Name: 2-(2-methyl-4-pyrrolidinosulfonyl-phenoxy)acetic acid Formula: C13H17NO5S MolecularWeight: 299.34278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OCC(=O)O

InChI

InChI=1S/C13H17NO5S/c1-10-8-11(4-5-12(10)19-9-13(15)16)20(17,18)14-6-2-3-7-14/h4-5,8H,2-3,6-7,9H2,1H3,(H,15,16)