3-azanyl-3-ethanoyl-4-oxidanyl-hexane-2,5-dione

Systemtic Name: 3-azanyl-3-ethanoyl-4-oxidanyl-hexane-2,5-dione Openeye Name: 3-acetyl-3-amino-4-hydroxy-hexane-2,5-dione CAS Name: 3-acetyl-3-amino-4-hydroxyhexane-2,5-dione IUPAC Name: 3-acetyl-3-amino-4-hydroxyhexane-2,5-dione Traditional Name: 3-acetyl-3-amino-4-hydroxy-hexane-2,5-dione Formula: C8H13NO4 MolecularWeight: 187.19312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H13NO4/c1-4(10)7(13)8(9,5(2)11)6(3)12/h7,13H,9H2,1-3H3