phenacyl 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)C(=O)OCC(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC1C2=NN(C(=C2)C(=O)OCC(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H18N2O3/c24-20(16-7-3-1-4-8-16)14-26-21(25)19-13-18(15-11-12-15)22-23(19)17-9-5-2-6-10-17/h1-10,13,15H,11-12,14H2