5-(4-tert-butylphenyl)-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: 5-(4-tert-butylphenyl)-1-phenyl-pyrazole-3-carboxylate Openeye Name: 5-(4-tert-butylphenyl)-1-phenyl-pyrazole-3-carboxylate CAS Name: 5-(4-tert-butylphenyl)-1-phenyl-3-pyrazolecarboxylate IUPAC Name: 5-(4-tert-butylphenyl)-1-phenylpyrazole-3-carboxylate Traditional Name: 5-(4-tert-butylphenyl)-1-phenyl-pyrazole-3-carboxylate Formula: C20H19N2O2- MolecularWeight: 319.37706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)[O-]

InChI

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