(4,4-dimethyl-2-phenyl-3H-pyrazol-5-yl) ethanoate

Systemtic Name: (4,4-dimethyl-2-phenyl-3H-pyrazol-5-yl) ethanoate Openeye Name: (4,4-dimethyl-2-phenyl-3H-pyrazol-5-yl) acetate CAS Name: acetic acid (4,4-dimethyl-2-phenyl-3H-pyrazol-5-yl) ester IUPAC Name: (4,4-dimethyl-2-phenyl-3H-pyrazol-5-yl) acetate Traditional Name: acetic acid (4,4-dimethyl-1-phenyl-2-pyrazolin-3-yl) ester Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=NN(CC1(C)C)C2=CC=CC=C2

Isomeric SMILES

CC(=O)OC1=NN(CC1(C)C)C2=CC=CC=C2

InChI

InChI=1S/C13H16N2O2/c1-10(16)17-12-13(2,3)9-15(14-12)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3