2-[4-[2,3,5-tris(fluoranyl)-4-methyl-6-nitro-phenoxy]benzotriazol-1-yl]ethanoate

Systemtic Name: 2-[4-[2,3,5-tris(fluoranyl)-4-methyl-6-nitro-phenoxy]benzotriazol-1-yl]ethanoate Openeye Name: 2-[4-(2,3,5-trifluoro-4-methyl-6-nitro-phenoxy)benzotriazol-1-yl]acetate CAS Name: 2-[4-(2,3,5-trifluoro-4-methyl-6-nitrophenoxy)-1-benzotriazolyl]acetate IUPAC Name: 2-[4-(2,3,5-trifluoro-4-methyl-6-nitrophenoxy)benzotriazol-1-yl]acetate Traditional Name: 2-[4-(2,3,5-trifluoro-4-methyl-6-nitro-phenoxy)benzotriazol-1-yl]acetate Formula: C15H8F3N4O5- MolecularWeight: 381.24303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1F)F)OC2=CC=CC3=C2N=NN3CC(=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C(=C(C(=C1F)F)OC2=CC=CC3=C2N=NN3CC(=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C15H9F3N4O5/c1-6-10(16)12(18)15(14(11(6)17)22(25)26)27-8-4-2-3-7-13(8)19-20-21(7)5-9(23)24/h2-4H,5H2,1H3,(H,23,24)/p-1