3-[5-(trifluoromethyl)pyridin-2-yl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[5-(trifluoromethyl)pyridin-2-yl]-2H-phthalazine-1,4-dione Openeye Name: 3-[5-(trifluoromethyl)-2-pyridyl]-2H-phthalazine-1,4-dione CAS Name: 3-[5-(trifluoromethyl)-2-pyridinyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[5-(trifluoromethyl)pyridin-2-yl]-2H-phthalazine-1,4-dione Traditional Name: 3-[5-(trifluoromethyl)-2-pyridyl]-2H-phthalazine-1,4-quinone Formula: C14H8F3N3O2 MolecularWeight: 307.22743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C14H8F3N3O2/c15-14(16,17)8-5-6-11(18-7-8)20-13(22)10-4-2-1-3-9(10)12(21)19-20/h1-7H,(H,19,21)