2-[2-[bis(carboxymethyl)amino]ethyl-(1-oxidanyl-1-oxidanylidene-decan-2-yl)amino]decanoic acid

Systemtic Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(1-oxidanyl-1-oxidanylidene-decan-2-yl)amino]decanoic acid Openeye Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(1-carboxynonyl)amino]decanoic acid CAS Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(1-hydroxy-1-oxodecan-2-yl)amino]decanoic acid IUPAC Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(1-hydroxy-1-oxodecan-2-yl)amino]decanoic acid Traditional Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(1-carboxynonyl)amino]capric acid Formula: C26H48N2O8 MolecularWeight: 516.66792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(=O)O)N(CCN(CC(=O)O)CC(=O)O)C(CCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCC(C(=O)O)N(CCN(CC(=O)O)CC(=O)O)C(CCCCCCCC)C(=O)O

InChI

InChI=1S/C26H48N2O8/c1-3-5-7-9-11-13-15-21(25(33)34)28(18-17-27(19-23(29)30)20-24(31)32)22(26(35)36)16-14-12-10-8-6-4-2/h21-22H,3-20H2,1-2H3,(H,29,30)(H,31,32)(H,33,34)(H,35,36)