(2,5-dimethylphenyl)methyl 2-(1-phenylpyrazol-4-yl)ethanoate

Systemtic Name: (2,5-dimethylphenyl)methyl 2-(1-phenylpyrazol-4-yl)ethanoate Openeye Name: (2,5-dimethylphenyl)methyl 2-(1-phenylpyrazol-4-yl)acetate CAS Name: 2-(1-phenyl-4-pyrazolyl)acetic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 2-(1-phenylpyrazol-4-yl)acetate Traditional Name: 2-(1-phenylpyrazol-4-yl)acetic acid (2,5-dimethylbenzyl) ester Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O2/c1-15-8-9-16(2)18(10-15)14-24-20(23)11-17-12-21-22(13-17)19-6-4-3-5-7-19/h3-10,12-13H,11,14H2,1-2H3