(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-(4-methylphenyl)ethanoate

Systemtic Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-(4-methylphenyl)ethanoate Openeye Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-(p-tolyl)acetate CAS Name: 2-(4-methylphenyl)acetic acid (4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methyl ester IUPAC Name: (4-cyano-5-methyl-2-phenylpyrazol-3-yl)methyl 2-(4-methylphenyl)acetate Traditional Name: 2-(p-tolyl)acetic acid (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl ester Formula: C21H19N3O2 MolecularWeight: 345.39446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(=O)OCC2=C(C(=NN2C3=CC=CC=C3)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)CC(=O)OCC2=C(C(=NN2C3=CC=CC=C3)C)C#N

InChI

InChI=1S/C21H19N3O2/c1-15-8-10-17(11-9-15)12-21(25)26-14-20-19(13-22)16(2)23-24(20)18-6-4-3-5-7-18/h3-11H,12,14H2,1-2H3