2-[[bis(2-methylsulfonyloxyethyl)amino]-(phenylcarbonyl)amino]pentanedioic acid

Systemtic Name: 2-[[bis(2-methylsulfonyloxyethyl)amino]-(phenylcarbonyl)amino]pentanedioic acid Openeye Name: 2-[benzoyl-[bis(2-methylsulfonyloxyethyl)amino]amino]pentanedioic acid CAS Name: 2-[benzoyl-[bis(2-methylsulfonyloxyethyl)amino]amino]pentanedioic acid IUPAC Name: 2-[benzoyl-[bis(2-methylsulfonyloxyethyl)amino]amino]pentanedioic acid Traditional Name: 2-[benzoyl-[bis(2-methylsulfonyloxyethyl)amino]amino]glutaric acid Formula: C18H26N2O11S2 MolecularWeight: 510.53584

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCN(CCOS(=O)(=O)C)N(C(CCC(=O)O)C(=O)O)C(=O)C1=CC=CC=C1

Isomeric SMILES

CS(=O)(=O)OCCN(CCOS(=O)(=O)C)N(C(CCC(=O)O)C(=O)O)C(=O)C1=CC=CC=C1

InChI

InChI=1S/C18H26N2O11S2/c1-32(26,27)30-12-10-19(11-13-31-33(2,28)29)20(15(18(24)25)8-9-16(21)22)17(23)14-6-4-3-5-7-14/h3-7,15H,8-13H2,1-2H3,(H,21,22)(H,24,25)