prop-2-ynyl 2-(5-methyl-1-phenyl-pyrazol-4-yl)carbonylpyrazolidine-1-carboxylate

Systemtic Name: prop-2-ynyl 2-(5-methyl-1-phenyl-pyrazol-4-yl)carbonylpyrazolidine-1-carboxylate Openeye Name: prop-2-ynyl 2-(5-methyl-1-phenyl-pyrazole-4-carbonyl)pyrazolidine-1-carboxylate CAS Name: 2-[(5-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]-1-pyrazolidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 2-(5-methyl-1-phenylpyrazole-4-carbonyl)pyrazolidine-1-carboxylate Traditional Name: 2-(5-methyl-1-phenyl-pyrazole-4-carbonyl)pyrazolidine-1-carboxylic acid propargyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCCN3C(=O)OCC#C

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCCN3C(=O)OCC#C

InChI

InChI=1S/C18H18N4O3/c1-3-12-25-18(24)21-11-7-10-20(21)17(23)16-13-19-22(14(16)2)15-8-5-4-6-9-15/h1,4-6,8-9,13H,7,10-12H2,2H3