[4-[5-(4-acetyloxyphenyl)-4,4-dimethyl-pyrazol-3-yl]phenyl] ethanoate

Systemtic Name: [4-[5-(4-acetyloxyphenyl)-4,4-dimethyl-pyrazol-3-yl]phenyl] ethanoate Openeye Name: [4-[5-(4-acetoxyphenyl)-4,4-dimethyl-pyrazol-3-yl]phenyl] acetate CAS Name: acetic acid [4-[5-(4-acetyloxyphenyl)-4,4-dimethyl-3-pyrazolyl]phenyl] ester IUPAC Name: [4-[5-(4-acetyloxyphenyl)-4,4-dimethylpyrazol-3-yl]phenyl] acetate Traditional Name: acetic acid [4-[5-(4-acetoxyphenyl)-4,4-dimethyl-pyrazol-3-yl]phenyl] ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2=NN=C(C2(C)C)C3=CC=C(C=C3)OC(=O)C

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2=NN=C(C2(C)C)C3=CC=C(C=C3)OC(=O)C

InChI

InChI=1S/C21H20N2O4/c1-13(24)26-17-9-5-15(6-10-17)19-21(3,4)20(23-22-19)16-7-11-18(12-8-16)27-14(2)25/h5-12H,1-4H3