(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-(trifluoromethyloxy)benzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-(trifluoromethyloxy)benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-(trifluoromethoxy)benzoate CAS Name: 4-(trifluoromethoxy)benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-(trifluoromethoxy)benzoate Traditional Name: 4-(trifluoromethoxy)benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C16H10F3N3O4 MolecularWeight: 365.26351

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C16H10F3N3O4/c17-16(18,19)26-11-7-5-10(6-8-11)15(24)25-9-22-14(23)12-3-1-2-4-13(12)20-21-22/h1-8H,9H2