methyl (3R,5S)-3,5-dimethyl-3,4-dihydropyrazole-5-carboxylate

Systemtic Name: methyl (3R,5S)-3,5-dimethyl-3,4-dihydropyrazole-5-carboxylate Openeye Name: methyl (3R,5S)-3,5-dimethyl-3,4-dihydropyrazole-5-carboxylate CAS Name: (3R,5S)-3,5-dimethyl-3,4-dihydropyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl (3R,5S)-3,5-dimethyl-3,4-dihydropyrazole-5-carboxylate Traditional Name: (3S,5R)-3,5-dimethyl-1-pyrazoline-3-carboxylic acid methyl ester Formula: C7H12N2O2 MolecularWeight: 156.18238

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N=N1)(C)C(=O)OC

Isomeric SMILES

C[C@@H]1C[C@@](N=N1)(C)C(=O)OC

InChI

InChI=1S/C7H12N2O2/c1-5-4-7(2,9-8-5)6(10)11-3/h5H,4H2,1-3H3/t5-,7+/m1/s1