[3-(trifluoromethyl)phenyl] 3-phenylcinnoline-4-carboxylate

Systemtic Name: [3-(trifluoromethyl)phenyl] 3-phenylcinnoline-4-carboxylate Openeye Name: [3-(trifluoromethyl)phenyl] 3-phenylcinnoline-4-carboxylate CAS Name: 3-phenyl-4-cinnolinecarboxylic acid [3-(trifluoromethyl)phenyl] ester IUPAC Name: [3-(trifluoromethyl)phenyl] 3-phenylcinnoline-4-carboxylate Traditional Name: 3-phenylcinnoline-4-carboxylic acid [3-(trifluoromethyl)phenyl] ester Formula: C22H13F3N2O2 MolecularWeight: 394.34603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N=N2)C(=O)OC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N=N2)C(=O)OC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C22H13F3N2O2/c23-22(24,25)15-9-6-10-16(13-15)29-21(28)19-17-11-4-5-12-18(17)26-27-20(19)14-7-2-1-3-8-14/h1-13H