[(2R,3R,5R)-5-azaniumyl-7-methoxy-3-oxidanyl-7-oxidanylidene-heptan-2-yl]azanium dichloride

Systemtic Name: [(2R,3R,5R)-5-azaniumyl-7-methoxy-3-oxidanyl-7-oxidanylidene-heptan-2-yl]azanium dichloride Openeye Name: [(1R,2R,4R)-4-azaniumyl-2-hydroxy-6-methoxy-1-methyl-6-oxo-hexyl]ammonium dichloride CAS Name: [(2R,3R,5R)-5-ammonio-3-hydroxy-7-methoxy-7-oxoheptan-2-yl]ammonium dichloride IUPAC Name: [(2R,3R,5R)-5-azaniumyl-3-hydroxy-7-methoxy-7-oxoheptan-2-yl]azanium dichloride Traditional Name: [(1R,3R,4R)-4-ammonio-3-hydroxy-1-(2-keto-2-methoxy-ethyl)pentyl]ammonium dichloride Formula: C8H20Cl2N2O3 MolecularWeight: 263.162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H18N2O3.2ClH/c1-5(9)7(11)3-6(10)4-8(12)13-2;;/h5-7,11H,3-4,9-10H2,1-2H3;2*1H/t5-,6-,7-;;/m1../s1