phenacyl 4-(3,5-dimethylpyrazol-1-yl)benzoate

Systemtic Name: phenacyl 4-(3,5-dimethylpyrazol-1-yl)benzoate Openeye Name: phenacyl 4-(3,5-dimethylpyrazol-1-yl)benzoate CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)benzoic acid phenacyl ester IUPAC Name: phenacyl 4-(3,5-dimethylpyrazol-1-yl)benzoate Traditional Name: 4-(3,5-dimethylpyrazol-1-yl)benzoic acid phenacyl ester Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H18N2O3/c1-14-12-15(2)22(21-14)18-10-8-17(9-11-18)20(24)25-13-19(23)16-6-4-3-5-7-16/h3-12H,13H2,1-2H3