(1-cyclopropyl-3-oxidanylidene-3-propan-2-yloxy-propyl)azanium; (2R,3R)-2,3,4-tris(oxidanyl)-4-oxidanylidene-butanoate

Systemtic Name: (1-cyclopropyl-3-oxidanylidene-3-propan-2-yloxy-propyl)azanium; (2R,3R)-2,3,4-tris(oxidanyl)-4-oxidanylidene-butanoate Openeye Name: (1-cyclopropyl-3-isopropoxy-3-oxo-propyl)ammonium; (2R,3R)-2,3,4-trihydroxy-4-oxo-butanoate CAS Name: (1-cyclopropyl-3-oxo-3-propan-2-yloxypropyl)ammonium; (2R,3R)-2,3,4-trihydroxy-4-oxobutanoate IUPAC Name: (1-cyclopropyl-3-oxo-3-propan-2-yloxypropyl)azanium; (2R,3R)-2,3,4-trihydroxy-4-oxobutanoate Traditional Name: (1-cyclopropyl-3-isopropoxy-3-keto-propyl)ammonium; (2R,3R)-2,3,4-trihydroxy-4-keto-butyrate Formula: C13H23NO8 MolecularWeight: 321.32362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1CC1)[NH3+].C(C(C(=O)[O-])O)(C(=O)O)O

Isomeric SMILES

CC(C)OC(=O)CC(C1CC1)[NH3+].[C@@H]([C@H](C(=O)[O-])O)(C(=O)O)O

InChI

InChI=1S/C9H17NO2.C4H6O6/c1-6(2)12-9(11)5-8(10)7-3-4-7;5-1(3(7)8)2(6)4(9)10/h6-8H,3-5,10H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1