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

Systemtic Name: 2,2-bis[[(6-oxidanyl-6-oxidanylidene-hexyl)amino]methyl]propanedioic acid Openeye Name: 2,2-bis[[(6-hydroxy-6-oxo-hexyl)amino]methyl]propanedioic acid CAS Name: 2,2-bis[[(6-hydroxy-6-oxohexyl)amino]methyl]propanedioic acid IUPAC Name: 2,2-bis[[(6-hydroxy-6-oxohexyl)amino]methyl]propanedioic acid Traditional Name: 2,2-bis[[(6-hydroxy-6-keto-hexyl)amino]methyl]malonic acid Formula: C17H30N2O8 MolecularWeight: 390.4287

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H30N2O8/c20-13(21)7-3-1-5-9-18-11-17(15(24)25,16(26)27)12-19-10-6-2-4-8-14(22)23/h18-19H,1-12H2,(H,20,21)(H,22,23)(H,24,25)(H,26,27)