(2S,4R)-4-oxidanyl-1-(1,3,5-trimethylpyrazol-4-yl)carbonyl-pyrrolidine-2-carboxylate

Systemtic Name: (2S,4R)-4-oxidanyl-1-(1,3,5-trimethylpyrazol-4-yl)carbonyl-pyrrolidine-2-carboxylate Openeye Name: (2S,4R)-4-hydroxy-1-(1,3,5-trimethylpyrazole-4-carbonyl)pyrrolidine-2-carboxylate CAS Name: (2S,4R)-4-hydroxy-1-[oxo-(1,3,5-trimethyl-4-pyrazolyl)methyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S,4R)-4-hydroxy-1-(1,3,5-trimethylpyrazole-4-carbonyl)pyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-hydroxy-1-(1,3,5-trimethylpyrazole-4-carbonyl)pyrrolidine-2-carboxylate Formula: C12H16N3O4- MolecularWeight: 266.27314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)N2CC(CC2C(=O)[O-])O

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)N2C[C@@H](C[C@H]2C(=O)[O-])O

InChI

InChI=1S/C12H17N3O4/c1-6-10(7(2)14(3)13-6)11(17)15-5-8(16)4-9(15)12(18)19/h8-9,16H,4-5H2,1-3H3,(H,18,19)/p-1/t8-,9+/m1/s1