benzotriazol-1-yl 4-[3-(trifluoromethyl)-1,2-diazirin-3-yl]benzoate

Systemtic Name: benzotriazol-1-yl 4-[3-(trifluoromethyl)-1,2-diazirin-3-yl]benzoate Openeye Name: benzotriazol-1-yl 4-[3-(trifluoromethyl)diazirin-3-yl]benzoate CAS Name: 4-[3-(trifluoromethyl)-3-diazirinyl]benzoic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 4-[3-(trifluoromethyl)diazirin-3-yl]benzoate Traditional Name: 4-[3-(trifluoromethyl)diazirin-3-yl]benzoic acid benzotriazol-1-yl ester Formula: C15H8F3N5O2 MolecularWeight: 347.25153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2OC(=O)C3=CC=C(C=C3)C4(N=N4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2OC(=O)C3=CC=C(C=C3)C4(N=N4)C(F)(F)F

InChI

InChI=1S/C15H8F3N5O2/c16-15(17,18)14(20-21-14)10-7-5-9(6-8-10)13(24)25-23-12-4-2-1-3-11(12)19-22-23/h1-8H