methyl (4S,5R)-4-oxidanyl-4,5-dihydro-1H-pyrazole-5-carboxylate

Systemtic Name: methyl (4S,5R)-4-oxidanyl-4,5-dihydro-1H-pyrazole-5-carboxylate Openeye Name: methyl (4S,5R)-4-hydroxy-4,5-dihydro-1H-pyrazole-5-carboxylate CAS Name: (4S,5R)-4-hydroxy-4,5-dihydro-1H-pyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl (4S,5R)-4-hydroxy-4,5-dihydro-1H-pyrazole-5-carboxylate Traditional Name: (3R,4S)-4-hydroxy-2-pyrazoline-3-carboxylic acid methyl ester Formula: C5H8N2O3 MolecularWeight: 144.12862

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C=NN1)O

Isomeric SMILES

COC(=O)[C@H]1[C@@H](C=NN1)O

InChI

InChI=1S/C5H8N2O3/c1-10-5(9)4-3(8)2-6-7-4/h2-4,7-8H,1H3/t3-,4-/m1/s1