azane; ethanol; 1,3,4,5,6-pentakis(oxidanyl)hexan-2-one

Systemtic Name: azane; ethanol; 1,3,4,5,6-pentakis(oxidanyl)hexan-2-one Openeye Name: ammonia; ethanol; 1,3,4,5,6-pentahydroxyhexan-2-one CAS Name: ammonia; ethanol; 1,3,4,5,6-pentahydroxy-2-hexanone IUPAC Name: azane; ethanol; 1,3,4,5,6-pentahydroxyhexan-2-one Traditional Name: ammonia; ethanol; 1,3,4,5,6-pentahydroxyhexan-2-one Formula: C12H33NO9 MolecularWeight: 335.39172

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Descriptors Computed from Structure

Canonical SMILES:

CCO.CCO.CCO.C(C(C(C(C(=O)CO)O)O)O)O.N

Isomeric SMILES

CCO.CCO.CCO.C(C(C(C(C(=O)CO)O)O)O)O.N

InChI

InChI=1S/C6H12O6.3C2H6O.H3N/c7-1-3(9)5(11)6(12)4(10)2-8;3*1-2-3;/h3,5-9,11-12H,1-2H2;3*3H,2H2,1H3;1H3