(5-tert-butyl-2-phenyl-pyrazol-3-yl) benzoate

Systemtic Name: (5-tert-butyl-2-phenyl-pyrazol-3-yl) benzoate Openeye Name: (5-tert-butyl-2-phenyl-pyrazol-3-yl) benzoate CAS Name: benzoic acid (5-tert-butyl-2-phenyl-3-pyrazolyl) ester IUPAC Name: (5-tert-butyl-2-phenylpyrazol-3-yl) benzoate Traditional Name: benzoic acid (5-tert-butyl-2-phenyl-pyrazol-3-yl) ester Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)OC(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)OC(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O2/c1-20(2,3)17-14-18(22(21-17)16-12-8-5-9-13-16)24-19(23)15-10-6-4-7-11-15/h4-14H,1-3H3