3-[2-carboxyethyl-(4-chlorophenyl)sulfonyl-amino]propanoic acid

Systemtic Name: 3-[2-carboxyethyl-(4-chlorophenyl)sulfonyl-amino]propanoic acid Openeye Name: 3-[2-carboxyethyl-(4-chlorophenyl)sulfonyl-amino]propanoic acid CAS Name: 3-[2-carboxyethyl-(4-chlorophenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[2-carboxyethyl-(4-chlorophenyl)sulfonylamino]propanoic acid Traditional Name: 3-[2-carboxyethyl-(4-chlorophenyl)sulfonyl-amino]propionic acid Formula: C12H14ClNO6S MolecularWeight: 335.76066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)N(CCC(=O)O)CCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)N(CCC(=O)O)CCC(=O)O)Cl

InChI

InChI=1S/C12H14ClNO6S/c13-9-1-3-10(4-2-9)21(19,20)14(7-5-11(15)16)8-6-12(17)18/h1-4H,5-8H2,(H,15,16)(H,17,18)