3-[1-[2-carboxyethyl(phenylsulfonyl)amino]ethyl-(phenylsulfonyl)amino]propanoic acid

Systemtic Name: 3-[1-[2-carboxyethyl(phenylsulfonyl)amino]ethyl-(phenylsulfonyl)amino]propanoic acid Openeye Name: 3-[benzenesulfonyl-[1-[benzenesulfonyl(2-carboxyethyl)amino]ethyl]amino]propanoic acid CAS Name: 3-[benzenesulfonyl-[1-[benzenesulfonyl(2-carboxyethyl)amino]ethyl]amino]propanoic acid IUPAC Name: 3-[benzenesulfonyl-[1-[benzenesulfonyl(2-carboxyethyl)amino]ethyl]amino]propanoic acid Traditional Name: 3-[besyl-[1-[besyl(2-carboxyethyl)amino]ethyl]amino]propionic acid Formula: C20H24N2O8S2 MolecularWeight: 484.54316

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Descriptors Computed from Structure

Canonical SMILES:

CC(N(CCC(=O)O)S(=O)(=O)C1=CC=CC=C1)N(CCC(=O)O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(N(CCC(=O)O)S(=O)(=O)C1=CC=CC=C1)N(CCC(=O)O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H24N2O8S2/c1-16(21(14-12-19(23)24)31(27,28)17-8-4-2-5-9-17)22(15-13-20(25)26)32(29,30)18-10-6-3-7-11-18/h2-11,16H,12-15H2,1H3,(H,23,24)(H,25,26)