methyl 1,5-dimethyl-3-(2-phenylethynyl)pyrazole-4-carboxylate

Systemtic Name: methyl 1,5-dimethyl-3-(2-phenylethynyl)pyrazole-4-carboxylate Openeye Name: methyl 1,5-dimethyl-3-(2-phenylethynyl)pyrazole-4-carboxylate CAS Name: 1,5-dimethyl-3-(2-phenylethynyl)-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1,5-dimethyl-3-(2-phenylethynyl)pyrazole-4-carboxylate Traditional Name: 1,5-dimethyl-3-(2-phenylethynyl)pyrazole-4-carboxylic acid methyl ester Formula: C15H14N2O2 MolecularWeight: 254.28386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C#CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C)C#CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C15H14N2O2/c1-11-14(15(18)19-3)13(16-17(11)2)10-9-12-7-5-4-6-8-12/h4-8H,1-3H3