2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-ethyl-amino]ethanoic acid

Systemtic Name: 2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-ethyl-amino]ethanoic acid Openeye Name: 2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-ethyl-amino]acetic acid CAS Name: 2-[(4-ethoxy-3-methylphenyl)sulfonyl-ethylamino]acetic acid IUPAC Name: 2-[(4-ethoxy-3-methylphenyl)sulfonyl-ethylamino]acetic acid Traditional Name: 2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-ethyl-amino]acetic acid Formula: C13H19NO5S MolecularWeight: 301.35866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)O)S(=O)(=O)C1=CC(=C(C=C1)OCC)C

Isomeric SMILES

CCN(CC(=O)O)S(=O)(=O)C1=CC(=C(C=C1)OCC)C

InChI

InChI=1S/C13H19NO5S/c1-4-14(9-13(15)16)20(17,18)11-6-7-12(19-5-2)10(3)8-11/h6-8H,4-5,9H2,1-3H3,(H,15,16)