2-[[5-(4-chloranyl-2-fluoranyl-3-phenyl-phenyl)-1-methyl-pyrazol-4-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[5-(4-chloranyl-2-fluoranyl-3-phenyl-phenyl)-1-methyl-pyrazol-4-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[5-(4-chloro-2-fluoro-3-phenyl-phenyl)-1-methyl-pyrazol-4-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[5-(4-chloro-2-fluoro-3-phenylphenyl)-1-methyl-4-pyrazolyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[5-(4-chloro-2-fluoro-3-phenylphenyl)-1-methylpyrazol-4-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[5-(4-chloro-2-fluoro-3-phenyl-phenyl)-1-methyl-pyrazol-4-yl]methyl]isoindoline-1,3-quinone Formula: C25H17ClFN3O2 MolecularWeight: 445.872783

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)CN2C(=O)C3=CC=CC=C3C2=O)C4=C(C(=C(C=C4)Cl)C5=CC=CC=C5)F

Isomeric SMILES

CN1C(=C(C=N1)CN2C(=O)C3=CC=CC=C3C2=O)C4=C(C(=C(C=C4)Cl)C5=CC=CC=C5)F

InChI

InChI=1S/C25H17ClFN3O2/c1-29-23(19-11-12-20(26)21(22(19)27)15-7-3-2-4-8-15)16(13-28-29)14-30-24(31)17-9-5-6-10-18(17)25(30)32/h2-13H,14H2,1H3