[(3S,4R,5R)-5-(hydroxymethyl)-4-oxidanyl-piperidin-1-ium-3-yl]azanium dichloride

Systemtic Name: [(3S,4R,5R)-5-(hydroxymethyl)-4-oxidanyl-piperidin-1-ium-3-yl]azanium dichloride Openeye Name: [(3S,4R,5R)-4-hydroxy-5-(hydroxymethyl)piperidin-1-ium-3-yl]ammonium dichloride CAS Name: [(3S,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-piperidin-1-iumyl]ammonium dichloride IUPAC Name: [(3S,4R,5R)-4-hydroxy-5-(hydroxymethyl)piperidin-1-ium-3-yl]azanium dichloride Traditional Name: [(3S,4R,5R)-4-hydroxy-5-methylol-piperidin-1-ium-3-yl]ammonium dichloride Formula: C6H16Cl2N2O2 MolecularWeight: 219.10944

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C[NH2+]1)[NH3+])O)CO.[Cl-].[Cl-]

Isomeric SMILES

C1[C@@H]([C@H]([C@H](C[NH2+]1)[NH3+])O)CO.[Cl-].[Cl-]

InChI

InChI=1S/C6H14N2O2.2ClH/c7-5-2-8-1-4(3-9)6(5)10;;/h4-6,8-10H,1-3,7H2;2*1H/t4-,5+,6-;;/m1../s1