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

Systemtic Name: 3-[(4-aminophenyl)sulfonyl-(2-carboxyethyl)amino]propanoic acid Openeye Name: 3-[(4-aminophenyl)sulfonyl-(2-carboxyethyl)amino]propanoic acid CAS Name: 3-[(4-aminophenyl)sulfonyl-(2-carboxyethyl)amino]propanoic acid IUPAC Name: 3-[(4-aminophenyl)sulfonyl-(2-carboxyethyl)amino]propanoic acid Traditional Name: 3-[2-carboxyethyl(sulfanilyl)amino]propionic acid Formula: C12H16N2O6S MolecularWeight: 316.33024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)S(=O)(=O)N(CCC(=O)O)CCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1N)S(=O)(=O)N(CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C12H16N2O6S/c13-9-1-3-10(4-2-9)21(19,20)14(7-5-11(15)16)8-6-12(17)18/h1-4H,5-8,13H2,(H,15,16)(H,17,18)