methyl 1-methyl-4-(3-phenoxyprop-1-ynyl)pyrazole-3-carboxylate

Systemtic Name: methyl 1-methyl-4-(3-phenoxyprop-1-ynyl)pyrazole-3-carboxylate Openeye Name: methyl 1-methyl-4-(3-phenoxyprop-1-ynyl)pyrazole-3-carboxylate CAS Name: 1-methyl-4-(3-phenoxyprop-1-ynyl)-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-methyl-4-(3-phenoxyprop-1-ynyl)pyrazole-3-carboxylate Traditional Name: 1-methyl-4-(3-phenoxyprop-1-ynyl)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#CCOC2=CC=CC=C2

Isomeric SMILES

CN1C=C(C(=N1)C(=O)OC)C#CCOC2=CC=CC=C2

InChI

InChI=1S/C15H14N2O3/c1-17-11-12(14(16-17)15(18)19-2)7-6-10-20-13-8-4-3-5-9-13/h3-5,8-9,11H,10H2,1-2H3