2-[4-azanyl-1,1,1-tris(fluoranyl)butan-2-yl]phthalazin-1-one

Systemtic Name: 2-[4-azanyl-1,1,1-tris(fluoranyl)butan-2-yl]phthalazin-1-one Openeye Name: 2-[3-amino-1-(trifluoromethyl)propyl]phthalazin-1-one CAS Name: 2-(4-amino-1,1,1-trifluorobutan-2-yl)-1-phthalazinone IUPAC Name: 2-(4-amino-1,1,1-trifluorobutan-2-yl)phthalazin-1-one Traditional Name: 2-[3-amino-1-(trifluoromethyl)propyl]phthalazin-1-one Formula: C12H12F3N3O MolecularWeight: 271.23839

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN(C2=O)C(CCN)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=NN(C2=O)C(CCN)C(F)(F)F

InChI

InChI=1S/C12H12F3N3O/c13-12(14,15)10(5-6-16)18-11(19)9-4-2-1-3-8(9)7-17-18/h1-4,7,10H,5-6,16H2