aluminum; 3-(dimethylamino)phenolate; tris(fluoranyl)methanesulfonic acid

Systemtic Name: aluminum; 3-(dimethylamino)phenolate; tris(fluoranyl)methanesulfonic acid Openeye Name: aluminum; 3-(dimethylamino)phenolate; trifluoromethanesulfonic acid CAS Name: aluminum; 3-(dimethylamino)phenolate; trifluoromethanesulfonic acid IUPAC Name: aluminum; 3-(dimethylamino)phenolate; trifluoromethanesulfonic acid Traditional Name: aluminum; 3-(dimethylamino)phenolate; triflic acid Formula: C26H32AlF6N3O9S2 MolecularWeight: 735.648937

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=CC=C1)[O-].CN(C)C1=CC(=CC=C1)[O-].CN(C)C1=CC(=CC=C1)[O-].C(F)(F)(F)S(=O)(=O)O.C(F)(F)(F)S(=O)(=O)O.[Al+3]

Isomeric SMILES

CN(C)C1=CC(=CC=C1)[O-].CN(C)C1=CC(=CC=C1)[O-].CN(C)C1=CC(=CC=C1)[O-].C(F)(F)(F)S(=O)(=O)O.C(F)(F)(F)S(=O)(=O)O.[Al+3]

InChI

InChI=1S/3C8H11NO.2CHF3O3S.Al/c3*1-9(2)7-4-3-5-8(10)6-7;2*2-1(3,4)8(5,6)7;/h3*3-6,10H,1-2H3;2*(H,5,6,7);/q;;;;;+3/p-3