2-[[(5S)-5-azanyl-6-oxidanyl-6-oxidanylidene-hexyl]amino]propanedioic acid

Systemtic Name: 2-[[(5S)-5-azanyl-6-oxidanyl-6-oxidanylidene-hexyl]amino]propanedioic acid Openeye Name: 2-[[(5S)-5-amino-6-hydroxy-6-oxo-hexyl]amino]propanedioic acid CAS Name: 2-[[(5S)-5-amino-6-hydroxy-6-oxohexyl]amino]propanedioic acid IUPAC Name: 2-[[(5S)-5-amino-6-hydroxy-6-oxohexyl]amino]propanedioic acid Traditional Name: 2-[[(5S)-5-amino-6-hydroxy-6-keto-hexyl]amino]malonic acid Formula: C9H16N2O6 MolecularWeight: 248.23314

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Descriptors Computed from Structure

Canonical SMILES:

C(CCNC(C(=O)O)C(=O)O)CC(C(=O)O)N

Isomeric SMILES

C(CCNC(C(=O)O)C(=O)O)C[C@@H](C(=O)O)N

InChI

InChI=1S/C9H16N2O6/c10-5(7(12)13)3-1-2-4-11-6(8(14)15)9(16)17/h5-6,11H,1-4,10H2,(H,12,13)(H,14,15)(H,16,17)/t5-/m0/s1