(4-ethanoylphenyl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate

Systemtic Name: (4-ethanoylphenyl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate Openeye Name: (4-acetylphenyl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate CAS Name: 5-cyclopropyl-2-phenyl-3-pyrazolecarboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 5-cyclopropyl-2-phenylpyrazole-3-carboxylate Traditional Name: 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylic acid (4-acetylphenyl) ester Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C21H18N2O3/c1-14(24)15-9-11-18(12-10-15)26-21(25)20-13-19(16-7-8-16)22-23(20)17-5-3-2-4-6-17/h2-6,9-13,16H,7-8H2,1H3