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

Systemtic Name: [2-(2,3-dimethylphenyl)-5-phenyl-pyrazol-3-yl] 3-methylbutanoate Openeye Name: [2-(2,3-dimethylphenyl)-5-phenyl-pyrazol-3-yl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [2-(2,3-dimethylphenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(2,3-dimethylphenyl)-5-phenylpyrazol-3-yl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [2-(2,3-dimethylphenyl)-5-phenyl-pyrazol-3-yl] ester Formula: C22H24N2O2 MolecularWeight: 348.43816

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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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O2/c1-15(2)13-22(25)26-21-14-19(18-10-6-5-7-11-18)23-24(21)20-12-8-9-16(3)17(20)4/h5-12,14-15H,13H2,1-4H3