4-[4-azanyl-1,1,1-tris(fluoranyl)butan-2-yl]-2-methyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[4-azanyl-1,1,1-tris(fluoranyl)butan-2-yl]-2-methyl-1,4-benzoxazin-3-one Openeye Name: 4-[3-amino-1-(trifluoromethyl)propyl]-2-methyl-1,4-benzoxazin-3-one CAS Name: 4-(4-amino-1,1,1-trifluorobutan-2-yl)-2-methyl-1,4-benzoxazin-3-one IUPAC Name: 4-(4-amino-1,1,1-trifluorobutan-2-yl)-2-methyl-1,4-benzoxazin-3-one Traditional Name: 4-[3-amino-1-(trifluoromethyl)propyl]-2-methyl-1,4-benzoxazin-3-one Formula: C13H15F3N2O2 MolecularWeight: 288.26561

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)C(CCN)C(F)(F)F

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2O1)C(CCN)C(F)(F)F

InChI

InChI=1S/C13H15F3N2O2/c1-8-12(19)18(11(6-7-17)13(14,15)16)9-4-2-3-5-10(9)20-8/h2-5,8,11H,6-7,17H2,1H3