2-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazine-3,6-dione

Systemtic Name: 2-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazine-3,6-dione Openeye Name: 2-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazine-3,6-dione CAS Name: 2-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazine-3,6-dione IUPAC Name: 2-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazine-3,6-dione Traditional Name: 2-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazine-3,6-quinone Formula: C12H6F6N2O2 MolecularWeight: 324.178659

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)N(NC1=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC(=O)N(NC1=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C12H6F6N2O2/c13-11(14,15)6-3-7(12(16,17)18)5-8(4-6)20-10(22)2-1-9(21)19-20/h1-5H,(H,19,21)