1-tert-butyl-3-propan-2-yl-5-(trifluoromethyl)pyridazin-4-one

Systemtic Name: 1-tert-butyl-3-propan-2-yl-5-(trifluoromethyl)pyridazin-4-one Openeye Name: 1-tert-butyl-3-isopropyl-5-(trifluoromethyl)pyridazin-4-one CAS Name: 1-tert-butyl-3-propan-2-yl-5-(trifluoromethyl)-4-pyridazinone IUPAC Name: 1-tert-butyl-3-propan-2-yl-5-(trifluoromethyl)pyridazin-4-one Traditional Name: 1-tert-butyl-3-isopropyl-5-(trifluoromethyl)pyridazin-4-one Formula: C12H17F3N2O MolecularWeight: 262.27139

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C=C(C1=O)C(F)(F)F)C(C)(C)C

Isomeric SMILES

CC(C)C1=NN(C=C(C1=O)C(F)(F)F)C(C)(C)C

InChI

InChI=1S/C12H17F3N2O/c1-7(2)9-10(18)8(12(13,14)15)6-17(16-9)11(3,4)5/h6-7H,1-5H3