[(3S,5R)-3-methyl-5-oxidanyl-2-propan-2-yl-pyrazolidin-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [(3S,5R)-3-methyl-5-oxidanyl-2-propan-2-yl-pyrazolidin-1-yl]-pyridin-4-yl-methanone Openeye Name: [(3S,5R)-5-hydroxy-2-isopropyl-3-methyl-pyrazolidin-1-yl]-(4-pyridyl)methanone CAS Name: [(3S,5R)-5-hydroxy-3-methyl-2-propan-2-yl-1-pyrazolidinyl]-pyridin-4-ylmethanone IUPAC Name: [(3S,5R)-5-hydroxy-3-methyl-2-propan-2-ylpyrazolidin-1-yl]-pyridin-4-ylmethanone Traditional Name: [(3S,5R)-5-hydroxy-2-isopropyl-3-methyl-pyrazolidin-1-yl]-(4-pyridyl)methanone Formula: C13H19N3O2 MolecularWeight: 249.30886

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(N1C(C)C)C(=O)C2=CC=NC=C2)O

Isomeric SMILES

C[C@H]1C[C@H](N(N1C(C)C)C(=O)C2=CC=NC=C2)O

InChI

InChI=1S/C13H19N3O2/c1-9(2)15-10(3)8-12(17)16(15)13(18)11-4-6-14-7-5-11/h4-7,9-10,12,17H,8H2,1-3H3/t10-,12+/m0/s1