methyl 4-[2-(4-methoxyphenyl)ethynyl]-1-methyl-pyrazole-3-carboxylate

Systemtic Name: methyl 4-[2-(4-methoxyphenyl)ethynyl]-1-methyl-pyrazole-3-carboxylate Openeye Name: methyl 4-[2-(4-methoxyphenyl)ethynyl]-1-methyl-pyrazole-3-carboxylate CAS Name: 4-[2-(4-methoxyphenyl)ethynyl]-1-methyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(4-methoxyphenyl)ethynyl]-1-methylpyrazole-3-carboxylate Traditional Name: 4-[2-(4-methoxyphenyl)ethynyl]-1-methyl-pyrazole-3-carboxylic acid methyl ester Formula: C15H14N2O3 MolecularWeight: 270.28326

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)OC)C#CC2=CC=C(C=C2)OC

Isomeric SMILES

CN1C=C(C(=N1)C(=O)OC)C#CC2=CC=C(C=C2)OC

InChI

InChI=1S/C15H14N2O3/c1-17-10-12(14(16-17)15(18)20-3)7-4-11-5-8-13(19-2)9-6-11/h5-6,8-10H,1-3H3