methyl (4S,5S)-5-ethanoyl-4-methyl-3,4-dihydropyrazole-5-carboxylate

Systemtic Name: methyl (4S,5S)-5-ethanoyl-4-methyl-3,4-dihydropyrazole-5-carboxylate Openeye Name: methyl (4S,5S)-5-acetyl-4-methyl-3,4-dihydropyrazole-5-carboxylate CAS Name: (4S,5S)-5-acetyl-4-methyl-3,4-dihydropyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl (4S,5S)-5-acetyl-4-methyl-3,4-dihydropyrazole-5-carboxylate Traditional Name: (3S,4S)-3-acetyl-4-methyl-1-pyrazoline-3-carboxylic acid methyl ester Formula: C8H12N2O3 MolecularWeight: 184.19248

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN=NC1(C(=O)C)C(=O)OC

Isomeric SMILES

C[C@H]1CN=N[C@@]1(C(=O)C)C(=O)OC

InChI

InChI=1S/C8H12N2O3/c1-5-4-9-10-8(5,6(2)11)7(12)13-3/h5H,4H2,1-3H3/t5-,8-/m0/s1