[2-(2,3-dimethylphenyl)-5-phenyl-pyrazol-3-yl] 3,3-dimethylbutanoate

Systemtic Name: [2-(2,3-dimethylphenyl)-5-phenyl-pyrazol-3-yl] 3,3-dimethylbutanoate Openeye Name: [2-(2,3-dimethylphenyl)-5-phenyl-pyrazol-3-yl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [2-(2,3-dimethylphenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(2,3-dimethylphenyl)-5-phenylpyrazol-3-yl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [2-(2,3-dimethylphenyl)-5-phenyl-pyrazol-3-yl] ester Formula: C23H26N2O2 MolecularWeight: 362.46474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=CC(=N2)C3=CC=CC=C3)OC(=O)CC(C)(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=CC(=N2)C3=CC=CC=C3)OC(=O)CC(C)(C)C)C

InChI

InChI=1S/C23H26N2O2/c1-16-10-9-13-20(17(16)2)25-21(27-22(26)15-23(3,4)5)14-19(24-25)18-11-7-6-8-12-18/h6-14H,15H2,1-5H3