[1-[(1S,2R)-2-azaniumylcyclopropyl]-1,1-dideuterio-3-oxidanyl-3-oxidanylidene-propan-2-yl]azanium dichloride

Systemtic Name: [1-[(1S,2R)-2-azaniumylcyclopropyl]-1,1-dideuterio-3-oxidanyl-3-oxidanylidene-propan-2-yl]azanium dichloride Openeye Name: [2-[(1S,2R)-2-azaniumylcyclopropyl]-1-carboxy-2,2-dideuterio-ethyl]ammonium dichloride CAS Name: [1-[(1S,2R)-2-ammoniocyclopropyl]-1,1-dideuterio-3-hydroxy-3-oxopropan-2-yl]ammonium dichloride IUPAC Name: [1-[(1S,2R)-2-azaniumylcyclopropyl]-1,1-dideuterio-3-hydroxy-3-oxopropan-2-yl]azanium dichloride Traditional Name: [2-[(1S,2R)-2-ammoniocyclopropyl]-1-carboxy-2,2-dideuterio-ethyl]ammonium dichloride Formula: C6H14Cl2N2O2 MolecularWeight: 219.105884

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1[NH3+])CC(C(=O)O)[NH3+].[Cl-].[Cl-]

Isomeric SMILES

[2H]C([2H])([C@@H]1C[C@H]1[NH3+])C(C(=O)O)[NH3+].[Cl-].[Cl-]

InChI

InChI=1S/C6H12N2O2.2ClH/c7-4-1-3(4)2-5(8)6(9)10;;/h3-5H,1-2,7-8H2,(H,9,10);2*1H/t3-,4+,5?;;/m0../s1/i2D2;;