3-bromanyl-1,1,1-tris(fluoranyl)-4-(pyridin-4-ylmethylamino)but-3-en-2-one

Systemtic Name: 3-bromanyl-1,1,1-tris(fluoranyl)-4-(pyridin-4-ylmethylamino)but-3-en-2-one Openeye Name: 3-bromo-1,1,1-trifluoro-4-(4-pyridylmethylamino)but-3-en-2-one CAS Name: 3-bromo-1,1,1-trifluoro-4-(pyridin-4-ylmethylamino)-3-buten-2-one IUPAC Name: 3-bromo-1,1,1-trifluoro-4-(pyridin-4-ylmethylamino)but-3-en-2-one Traditional Name: 3-bromo-1,1,1-trifluoro-4-(4-pyridylmethylamino)but-3-en-2-one Formula: C10H8BrF3N2O MolecularWeight: 309.08253

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CNC=C(C(=O)C(F)(F)F)Br

Isomeric SMILES

C1=CN=CC=C1CNC=C(C(=O)C(F)(F)F)Br

InChI

InChI=1S/C10H8BrF3N2O/c11-8(9(17)10(12,13)14)6-16-5-7-1-3-15-4-2-7/h1-4,6,16H,5H2