2-ethyl-2-[[(6-oxidanyl-6-oxidanylidene-hexyl)amino]methyl]propanedioic acid

Systemtic Name: 2-ethyl-2-[[(6-oxidanyl-6-oxidanylidene-hexyl)amino]methyl]propanedioic acid Openeye Name: 2-ethyl-2-[[(6-hydroxy-6-oxo-hexyl)amino]methyl]propanedioic acid CAS Name: 2-ethyl-2-[[(6-hydroxy-6-oxohexyl)amino]methyl]propanedioic acid IUPAC Name: 2-ethyl-2-[[(6-hydroxy-6-oxohexyl)amino]methyl]propanedioic acid Traditional Name: 2-ethyl-2-[[(6-hydroxy-6-keto-hexyl)amino]methyl]malonic acid Formula: C12H21NO6 MolecularWeight: 275.29824

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNCCCCCC(=O)O)(C(=O)O)C(=O)O

Isomeric SMILES

CCC(CNCCCCCC(=O)O)(C(=O)O)C(=O)O

InChI

InChI=1S/C12H21NO6/c1-2-12(10(16)17,11(18)19)8-13-7-5-3-4-6-9(14)15/h13H,2-8H2,1H3,(H,14,15)(H,16,17)(H,18,19)