[(2,6-dimethyl-4-nitro-phenoxy)-methyl-alumanyl] 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: [(2,6-dimethyl-4-nitro-phenoxy)-methyl-alumanyl] 2,2,2-tris(fluoranyl)ethanoate Openeye Name: [(2,6-dimethyl-4-nitro-phenoxy)-methyl-alumanyl] 2,2,2-trifluoroacetate CAS Name: 2,2,2-trifluoroacetic acid [(2,6-dimethyl-4-nitrophenoxy)-methylalumanyl] ester IUPAC Name: [(2,6-dimethyl-4-nitrophenoxy)-methylalumanyl] 2,2,2-trifluoroacetate Traditional Name: 2,2,2-trifluoroacetic acid [(2,6-dimethyl-4-nitro-phenoxy)-methyl-alumanyl] ester Formula: C11H11AlF3NO5 MolecularWeight: 321.185488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O[Al](C)OC(=O)C(F)(F)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1O[Al](C)OC(=O)C(F)(F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C8H9NO3.C2HF3O2.CH3.Al/c1-5-3-7(9(11)12)4-6(2)8(5)10;3-2(4,5)1(6)7;;/h3-4,10H,1-2H3;(H,6,7);1H3;/q;;;+2/p-2