(2R,3R,4S,5R)-2-azanyl-3,4,5,6-tetrakis(oxidanyl)hexanal; 2-(diethylamino)-N-(2,6-dimethylphenyl)ethanamide; sulfuric acid; dihydrochloride; hydroiodide

Systemtic Name: (2R,3R,4S,5R)-2-azanyl-3,4,5,6-tetrakis(oxidanyl)hexanal; 2-(diethylamino)-N-(2,6-dimethylphenyl)ethanamide; sulfuric acid; dihydrochloride; hydroiodide Openeye Name: (2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxy-hexanal; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide; sulfuric acid; dihydrochloride; hydroiodide CAS Name: (2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxyhexanal; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide; sulfuric acid; dihydrochloride; hydroiodide IUPAC Name: (2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxyhexanal; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide; sulfuric acid; dihydrochloride; hydroiodide Traditional Name: (2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxy-hexanal; 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide; sulfuric acid; dihydrochloride; hydroiodide Formula: C32H66Cl2IN5O20S MolecularWeight: 1070.76341

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.C(C(C(C(C(C=O)N)O)O)O)O.C(C(C(C(C(C=O)N)O)O)O)O.C(C(C(C(C(C=O)N)O)O)O)O.OS(=O)(=O)O.Cl.Cl.I

Isomeric SMILES

CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.C([C@H]([C@H]([C@@H]([C@H](C=O)N)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C=O)N)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C=O)N)O)O)O)O.OS(=O)(=O)O.Cl.Cl.I

InChI

InChI=1S/C14H22N2O.3C6H13NO5.2ClH.HI.H2O4S/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4;3*7-3(1-8)5(11)6(12)4(10)2-9;;;;1-5(2,3)4/h7-9H,5-6,10H2,1-4H3,(H,15,17);3*1,3-6,9-12H,2,7H2;3*1H;(H2,1,2,3,4)/t;3*3-,4+,5+,6+;;;;/m.000..../s1