2-[(3,4-dichlorophenyl)-methylsulfonyl-amino]propanoic acid

Systemtic Name: 2-[(3,4-dichlorophenyl)-methylsulfonyl-amino]propanoic acid Openeye Name: 2-(3,4-dichloro-N-methylsulfonyl-anilino)propanoic acid CAS Name: 2-(3,4-dichloro-N-methylsulfonylanilino)propanoic acid IUPAC Name: 2-(3,4-dichloro-N-methylsulfonylanilino)propanoic acid Traditional Name: 2-(3,4-dichloro-N-mesyl-anilino)propionic acid Formula: C10H11Cl2NO4S MolecularWeight: 312.16964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC(=C(C=C1)Cl)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)O)N(C1=CC(=C(C=C1)Cl)Cl)S(=O)(=O)C

InChI

InChI=1S/C10H11Cl2NO4S/c1-6(10(14)15)13(18(2,16)17)7-3-4-8(11)9(12)5-7/h3-6H,1-2H3,(H,14,15)