6-[(1S)-1-azanyl-2,2,2-tris(fluoranyl)ethyl]-4-propan-2-yl-1,4-benzoxazin-3-one

Systemtic Name: 6-[(1S)-1-azanyl-2,2,2-tris(fluoranyl)ethyl]-4-propan-2-yl-1,4-benzoxazin-3-one Openeye Name: 6-[(1S)-1-amino-2,2,2-trifluoro-ethyl]-4-isopropyl-1,4-benzoxazin-3-one CAS Name: 6-[(1S)-1-amino-2,2,2-trifluoroethyl]-4-propan-2-yl-1,4-benzoxazin-3-one IUPAC Name: 6-[(1S)-1-amino-2,2,2-trifluoroethyl]-4-propan-2-yl-1,4-benzoxazin-3-one Traditional Name: 6-[(1S)-1-amino-2,2,2-trifluoro-ethyl]-4-isopropyl-1,4-benzoxazin-3-one Formula: C13H15F3N2O2 MolecularWeight: 288.26561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)COC2=C1C=C(C=C2)C(C(F)(F)F)N

Isomeric SMILES

CC(C)N1C(=O)COC2=C1C=C(C=C2)[C@@H](C(F)(F)F)N

InChI

InChI=1S/C13H15F3N2O2/c1-7(2)18-9-5-8(12(17)13(14,15)16)3-4-10(9)20-6-11(18)19/h3-5,7,12H,6,17H2,1-2H3/t12-/m0/s1