2-[[2,2,2-tris(fluoranyl)ethylamino]methyl]isoquinolin-1-one

Systemtic Name: 2-[[2,2,2-tris(fluoranyl)ethylamino]methyl]isoquinolin-1-one Openeye Name: 2-[(2,2,2-trifluoroethylamino)methyl]isoquinolin-1-one CAS Name: 2-[(2,2,2-trifluoroethylamino)methyl]-1-isoquinolinone IUPAC Name: 2-[(2,2,2-trifluoroethylamino)methyl]isoquinolin-1-one Traditional Name: 2-[(2,2,2-trifluoroethylamino)methyl]isocarbostyril Formula: C12H11F3N2O MolecularWeight: 256.22375

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN(C2=O)CNCC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CN(C2=O)CNCC(F)(F)F

InChI

InChI=1S/C12H11F3N2O/c13-12(14,15)7-16-8-17-6-5-9-3-1-2-4-10(9)11(17)18/h1-6,16H,7-8H2