methyl 5-ethynyl-1H-pyrazole-3-carboxylate

Systemtic Name: methyl 5-ethynyl-1H-pyrazole-3-carboxylate Openeye Name: methyl 5-ethynyl-1H-pyrazole-3-carboxylate CAS Name: 5-ethynyl-1H-pyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-ethynyl-1H-pyrazole-3-carboxylate Traditional Name: 5-ethynyl-1H-pyrazole-3-carboxylic acid methyl ester Formula: C7H6N2O2 MolecularWeight: 150.13474

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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/C7H6N2O2/c1-3-5-4-6(9-8-5)7(10)11-2/h1,4H,2H3,(H,8,9)