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

Systemtic Name: 4-[3-azanyl-1,1,1-tris(fluoranyl)propan-2-yl]-2-methyl-1,4-benzoxazin-3-one Openeye Name: 4-[1-(aminomethyl)-2,2,2-trifluoro-ethyl]-2-methyl-1,4-benzoxazin-3-one CAS Name: 4-(3-amino-1,1,1-trifluoropropan-2-yl)-2-methyl-1,4-benzoxazin-3-one IUPAC Name: 4-(3-amino-1,1,1-trifluoropropan-2-yl)-2-methyl-1,4-benzoxazin-3-one Traditional Name: 4-[1-(aminomethyl)-2,2,2-trifluoro-ethyl]-2-methyl-1,4-benzoxazin-3-one Formula: C12H13F3N2O2 MolecularWeight: 274.23903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13F3N2O2/c1-7-11(18)17(10(6-16)12(13,14)15)8-4-2-3-5-9(8)19-7/h2-5,7,10H,6,16H2,1H3