ethyl 2-[3-[2,5-bis(fluoranyl)phenyl]-5-methyl-5-phenyl-4H-pyrazol-1-yl]propanoate

Systemtic Name: ethyl 2-[3-[2,5-bis(fluoranyl)phenyl]-5-methyl-5-phenyl-4H-pyrazol-1-yl]propanoate Openeye Name: ethyl 2-[3-(2,5-difluorophenyl)-5-methyl-5-phenyl-4H-pyrazol-1-yl]propanoate CAS Name: 2-[3-(2,5-difluorophenyl)-5-methyl-5-phenyl-4H-pyrazol-1-yl]propanoic acid ethyl ester IUPAC Name: ethyl 2-[3-(2,5-difluorophenyl)-5-methyl-5-phenyl-4H-pyrazol-1-yl]propanoate Traditional Name: 2-[3-(2,5-difluorophenyl)-5-methyl-5-phenyl-2-pyrazolin-1-yl]propionic acid ethyl ester Formula: C21H22F2N2O2 MolecularWeight: 372.408386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)N1C(CC(=N1)C2=C(C=CC(=C2)F)F)(C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(C)N1C(CC(=N1)C2=C(C=CC(=C2)F)F)(C)C3=CC=CC=C3

InChI

InChI=1S/C21H22F2N2O2/c1-4-27-20(26)14(2)25-21(3,15-8-6-5-7-9-15)13-19(24-25)17-12-16(22)10-11-18(17)23/h5-12,14H,4,13H2,1-3H3