2-[methylsulfonyl-(2-propan-2-ylphenyl)amino]ethanoic acid

Systemtic Name: 2-[methylsulfonyl-(2-propan-2-ylphenyl)amino]ethanoic acid Openeye Name: 2-(2-isopropyl-N-methylsulfonyl-anilino)acetic acid CAS Name: 2-(N-methylsulfonyl-2-propan-2-ylanilino)acetic acid IUPAC Name: 2-(N-methylsulfonyl-2-propan-2-ylanilino)acetic acid Traditional Name: 2-(2-isopropyl-N-mesyl-anilino)acetic acid Formula: C12H17NO4S MolecularWeight: 271.33268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N(CC(=O)O)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=CC=C1N(CC(=O)O)S(=O)(=O)C

InChI

InChI=1S/C12H17NO4S/c1-9(2)10-6-4-5-7-11(10)13(8-12(14)15)18(3,16)17/h4-7,9H,8H2,1-3H3,(H,14,15)