(2,6-dimethylphenyl) 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoate

Systemtic Name: (2,6-dimethylphenyl) 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoate Openeye Name: (2,6-dimethylphenyl) 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetate CAS Name: 2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)acetic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetate Traditional Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetic acid (2,6-dimethylphenyl) ester Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)CC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)CC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H22N2O2/c1-14-9-8-10-15(2)21(14)25-20(24)13-19-16(3)22-23(17(19)4)18-11-6-5-7-12-18/h5-12H,13H2,1-4H3