1-(5-isocyano-3,6-dimethyl-pyridin-2-yl)-3-methyl-4-(trifluoromethyl)pyrrole-2,5-dione

Systemtic Name: 1-(5-isocyano-3,6-dimethyl-pyridin-2-yl)-3-methyl-4-(trifluoromethyl)pyrrole-2,5-dione Openeye Name: 1-(5-isocyano-3,6-dimethyl-2-pyridyl)-3-methyl-4-(trifluoromethyl)pyrrole-2,5-dione CAS Name: 1-(5-isocyano-3,6-dimethyl-2-pyridinyl)-3-methyl-4-(trifluoromethyl)pyrrole-2,5-dione IUPAC Name: 1-(5-isocyano-3,6-dimethylpyridin-2-yl)-3-methyl-4-(trifluoromethyl)pyrrole-2,5-dione Traditional Name: 1-(5-isocyano-3,6-dimethyl-2-pyridyl)-3-methyl-4-(trifluoromethyl)-3-pyrroline-2,5-quinone Formula: C14H10F3N3O2 MolecularWeight: 309.24331

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N=C1N2C(=O)C(=C(C2=O)C(F)(F)F)C)C)[N+]#[C-]

Isomeric SMILES

CC1=CC(=C(N=C1N2C(=O)C(=C(C2=O)C(F)(F)F)C)C)[N+]#[C-]

InChI

InChI=1S/C14H10F3N3O2/c1-6-5-9(18-4)8(3)19-11(6)20-12(21)7(2)10(13(20)22)14(15,16)17/h5H,1-3H3