[2-(2,3-dimethylphenyl)-5-propan-2-yl-pyrazol-3-yl] benzoate

Systemtic Name: [2-(2,3-dimethylphenyl)-5-propan-2-yl-pyrazol-3-yl] benzoate Openeye Name: [2-(2,3-dimethylphenyl)-5-isopropyl-pyrazol-3-yl] benzoate CAS Name: benzoic acid [2-(2,3-dimethylphenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(2,3-dimethylphenyl)-5-propan-2-ylpyrazol-3-yl] benzoate Traditional Name: benzoic acid [2-(2,3-dimethylphenyl)-5-isopropyl-pyrazol-3-yl] ester Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O2/c1-14(2)18-13-20(25-21(24)17-10-6-5-7-11-17)23(22-18)19-12-8-9-15(3)16(19)4/h5-14H,1-4H3