2-[(3-cyanophenyl)methylsulfonylamino]propanoic acid

Systemtic Name: 2-[(3-cyanophenyl)methylsulfonylamino]propanoic acid Openeye Name: 2-[(3-cyanophenyl)methylsulfonylamino]propanoic acid CAS Name: 2-[(3-cyanophenyl)methylsulfonylamino]propanoic acid IUPAC Name: 2-[(3-cyanophenyl)methylsulfonylamino]propanoic acid Traditional Name: 2-[(3-cyanobenzyl)sulfonylamino]propionic acid Formula: C11H12N2O4S MolecularWeight: 268.28898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NS(=O)(=O)CC1=CC=CC(=C1)C#N

Isomeric SMILES

CC(C(=O)O)NS(=O)(=O)CC1=CC=CC(=C1)C#N

InChI

InChI=1S/C11H12N2O4S/c1-8(11(14)15)13-18(16,17)7-10-4-2-3-9(5-10)6-12/h2-5,8,13H,7H2,1H3,(H,14,15)