2-[(4-methylphenyl)-pyridin-3-ylsulfonyl-amino]propanoic acid

Systemtic Name: 2-[(4-methylphenyl)-pyridin-3-ylsulfonyl-amino]propanoic acid Openeye Name: 2-[4-methyl-N-(3-pyridylsulfonyl)anilino]propanoic acid CAS Name: 2-[4-methyl-N-(3-pyridinylsulfonyl)anilino]propanoic acid IUPAC Name: 2-(4-methyl-N-pyridin-3-ylsulfonylanilino)propanoic acid Traditional Name: 2-[4-methyl-N-(3-pyridylsulfonyl)anilino]propionic acid Formula: C15H16N2O4S MolecularWeight: 320.36354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(C)C(=O)O)S(=O)(=O)C2=CN=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)N(C(C)C(=O)O)S(=O)(=O)C2=CN=CC=C2

InChI

InChI=1S/C15H16N2O4S/c1-11-5-7-13(8-6-11)17(12(2)15(18)19)22(20,21)14-4-3-9-16-10-14/h3-10,12H,1-2H3,(H,18,19)