7-phenyl-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one

Systemtic Name: 7-phenyl-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one Openeye Name: 7-phenyl-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one CAS Name: 7-phenyl-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one IUPAC Name: 7-phenyl-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one Traditional Name: 7-phenyl-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one Formula: C21H13F3N2O MolecularWeight: 366.33593

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)C3=CC(=NNC3=C2)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)C3=CC(=NNC3=C2)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H13F3N2O/c22-21(23,24)16-8-4-7-14(9-16)18-12-17-19(26-25-18)10-15(11-20(17)27)13-5-2-1-3-6-13/h1-12,26H