ethyl 1-(4-ethanoylphenyl)-3-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-ethanoylphenyl)-3-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-(4-acetylphenyl)-3-phenyl-pyrazole-4-carboxylate CAS Name: 1-(4-acetylphenyl)-3-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-acetylphenyl)-3-phenylpyrazole-4-carboxylate Traditional Name: 1-(4-acetylphenyl)-3-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCOC(=O)C1=CN(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C20H18N2O3/c1-3-25-20(24)18-13-22(17-11-9-15(10-12-17)14(2)23)21-19(18)16-7-5-4-6-8-16/h4-13H,3H2,1-2H3