5-[2-[bis(carboxymethyl)amino]ethyl]-6-(dioxidanyl)hept-6-enoic acid

Systemtic Name: 5-[2-[bis(carboxymethyl)amino]ethyl]-6-(dioxidanyl)hept-6-enoic acid Openeye Name: 5-[2-[bis(carboxymethyl)amino]ethyl]-6-hydroperoxy-hept-6-enoic acid CAS Name: 5-[2-[bis(carboxymethyl)amino]ethyl]-6-hydroperoxy-6-heptenoic acid IUPAC Name: 5-[2-[bis(carboxymethyl)amino]ethyl]-6-hydroperoxyhept-6-enoic acid Traditional Name: 5-[2-[bis(carboxymethyl)amino]ethyl]-6-hydroperoxy-hept-6-enoic acid Formula: C13H21NO8 MolecularWeight: 319.30774

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(CCCC(=O)O)CCN(CC(=O)O)CC(=O)O)OO

Isomeric SMILES

C=C(C(CCCC(=O)O)CCN(CC(=O)O)CC(=O)O)OO

InChI

InChI=1S/C13H21NO8/c1-9(22-21)10(3-2-4-11(15)16)5-6-14(7-12(17)18)8-13(19)20/h10,21H,1-8H2,(H,15,16)(H,17,18)(H,19,20)