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

Systemtic Name: 3-[3-azanyl-1,1,1-tris(fluoranyl)propan-2-yl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[1-(aminomethyl)-2,2,2-trifluoro-ethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-(3-amino-1,1,1-trifluoropropan-2-yl)-1,2,3-benzotriazin-4-one IUPAC Name: 3-(3-amino-1,1,1-trifluoropropan-2-yl)-1,2,3-benzotriazin-4-one Traditional Name: 3-[1-(aminomethyl)-2,2,2-trifluoro-ethyl]-1,2,3-benzotriazin-4-one Formula: C10H9F3N4O MolecularWeight: 258.19987

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)C(CN)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)C(CN)C(F)(F)F

InChI

InChI=1S/C10H9F3N4O/c11-10(12,13)8(5-14)17-9(18)6-3-1-2-4-7(6)15-16-17/h1-4,8H,5,14H2