methyl 5-ethynyl-4,5-dihydro-1H-pyrazole-3-carboxylate

Systemtic Name: methyl 5-ethynyl-4,5-dihydro-1H-pyrazole-3-carboxylate Openeye Name: methyl 5-ethynyl-4,5-dihydro-1H-pyrazole-3-carboxylate CAS Name: 5-ethynyl-4,5-dihydro-1H-pyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-ethynyl-4,5-dihydro-1H-pyrazole-3-carboxylate Traditional Name: 5-ethynyl-2-pyrazoline-3-carboxylic acid methyl ester Formula: C7H8N2O2 MolecularWeight: 152.15062

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NNC(C1)C#C

Isomeric SMILES

COC(=O)C1=NNC(C1)C#C

InChI

InChI=1S/C7H8N2O2/c1-3-5-4-6(9-8-5)7(10)11-2/h1,5,8H,4H2,2H3