(4S,5R)-2,4-dimethyl-5-oxidanyl-2-propan-2-yl-pyrazolidin-2-ium-1-carbaldehyde

Systemtic Name: (4S,5R)-2,4-dimethyl-5-oxidanyl-2-propan-2-yl-pyrazolidin-2-ium-1-carbaldehyde Openeye Name: (4S,5R)-5-hydroxy-2-isopropyl-2,4-dimethyl-pyrazolidin-2-ium-1-carbaldehyde CAS Name: (4S,5R)-5-hydroxy-2,4-dimethyl-2-propan-2-yl-1-pyrazolidin-2-iumcarboxaldehyde IUPAC Name: (4S,5R)-5-hydroxy-2,4-dimethyl-2-propan-2-ylpyrazolidin-2-ium-1-carbaldehyde Traditional Name: (4S,5R)-5-hydroxy-2-isopropyl-2,4-dimethyl-pyrazolidin-2-ium-1-carbaldehyde Formula: C9H19N2O2+ MolecularWeight: 187.25936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C[N+](N(C1O)C=O)(C)C(C)C

Isomeric SMILES

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

InChI

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