(4,4-dimethyl-3,5,5-triphenyl-pyrazol-3-yl) ethanoate

Systemtic Name: (4,4-dimethyl-3,5,5-triphenyl-pyrazol-3-yl) ethanoate Openeye Name: (4,4-dimethyl-3,5,5-triphenyl-pyrazol-3-yl) acetate CAS Name: acetic acid (4,4-dimethyl-3,5,5-triphenyl-3-pyrazolyl) ester IUPAC Name: (4,4-dimethyl-3,5,5-triphenylpyrazol-3-yl) acetate Traditional Name: acetic acid (4,4-dimethyl-3,5,5-triphenyl-1-pyrazolin-3-yl) ester Formula: C25H24N2O2 MolecularWeight: 384.47026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C(C(N=N1)(C2=CC=CC=C2)C3=CC=CC=C3)(C)C)C4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1(C(C(N=N1)(C2=CC=CC=C2)C3=CC=CC=C3)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C25H24N2O2/c1-19(28)29-25(22-17-11-6-12-18-22)23(2,3)24(26-27-25,20-13-7-4-8-14-20)21-15-9-5-10-16-21/h4-18H,1-3H3