[3-(trifluoromethyl)phenyl] 4-oxidanylidene-3-phenyl-phthalazine-1-carboxylate

Systemtic Name: [3-(trifluoromethyl)phenyl] 4-oxidanylidene-3-phenyl-phthalazine-1-carboxylate Openeye Name: [3-(trifluoromethyl)phenyl] 4-oxo-3-phenyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-phenyl-1-phthalazinecarboxylic acid [3-(trifluoromethyl)phenyl] ester IUPAC Name: [3-(trifluoromethyl)phenyl] 4-oxo-3-phenylphthalazine-1-carboxylate Traditional Name: 4-keto-3-phenyl-phthalazine-1-carboxylic acid [3-(trifluoromethyl)phenyl] ester Formula: C22H13F3N2O3 MolecularWeight: 410.34543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)OC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)OC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C22H13F3N2O3/c23-22(24,25)14-7-6-10-16(13-14)30-21(29)19-17-11-4-5-12-18(17)20(28)27(26-19)15-8-2-1-3-9-15/h1-13H