2-[2-[carboxymethyl(phenylsulfonyl)amino]ethyl-(phenylsulfonyl)amino]ethanoic acid

Systemtic Name: 2-[2-[carboxymethyl(phenylsulfonyl)amino]ethyl-(phenylsulfonyl)amino]ethanoic acid Openeye Name: 2-[benzenesulfonyl-[2-[benzenesulfonyl(carboxymethyl)amino]ethyl]amino]acetic acid CAS Name: 2-[benzenesulfonyl-[2-[benzenesulfonyl(carboxymethyl)amino]ethyl]amino]acetic acid IUPAC Name: 2-[benzenesulfonyl-[2-[benzenesulfonyl(carboxymethyl)amino]ethyl]amino]acetic acid Traditional Name: 2-[besyl-[2-[besyl(carboxymethyl)amino]ethyl]amino]acetic acid Formula: C18H20N2O8S2 MolecularWeight: 456.49

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CCN(CC(=O)O)S(=O)(=O)C2=CC=CC=C2)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CCN(CC(=O)O)S(=O)(=O)C2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C18H20N2O8S2/c21-17(22)13-19(29(25,26)15-7-3-1-4-8-15)11-12-20(14-18(23)24)30(27,28)16-9-5-2-6-10-16/h1-10H,11-14H2,(H,21,22)(H,23,24)