(3S,5R)-2,3-dimethyl-5-oxidanyl-2-propan-2-yl-pyrazolidin-2-ium-1-carbaldehyde

Systemtic Name: (3S,5R)-2,3-dimethyl-5-oxidanyl-2-propan-2-yl-pyrazolidin-2-ium-1-carbaldehyde Openeye Name: (3S,5R)-5-hydroxy-2-isopropyl-2,3-dimethyl-pyrazolidin-2-ium-1-carbaldehyde CAS Name: (3S,5R)-5-hydroxy-2,3-dimethyl-2-propan-2-yl-1-pyrazolidin-2-iumcarboxaldehyde IUPAC Name: (3S,5R)-5-hydroxy-2,3-dimethyl-2-propan-2-ylpyrazolidin-2-ium-1-carbaldehyde Traditional Name: (3S,5R)-5-hydroxy-2-isopropyl-2,3-dimethyl-pyrazolidin-2-ium-1-carbaldehyde Formula: C9H19N2O2+ MolecularWeight: 187.25936

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N([N+]1(C)C(C)C)C=O)O

Isomeric SMILES

C[C@H]1C[C@H](N([N+]1(C)C(C)C)C=O)O

InChI

InChI=1S/C9H19N2O2/c1-7(2)11(4)8(3)5-9(13)10(11)6-12/h6-9,13H,5H2,1-4H3/q+1/t8-,9+,11?/m0/s1