2,6-dimethylphenol; lanthanum; oxolane; tris(fluoranyl)methanesulfonic acid

Systemtic Name: 2,6-dimethylphenol; lanthanum; oxolane; tris(fluoranyl)methanesulfonic acid Openeye Name: 2,6-dimethylphenol; lanthanum; tetrahydrofuran; trifluoromethanesulfonic acid CAS Name: 2,6-dimethylphenol; lanthanum; oxolane; trifluoromethanesulfonic acid IUPAC Name: 2,6-dimethylphenol; lanthanum; oxolane; trifluoromethanesulfonic acid Traditional Name: lanthanum; tetrahydrofuran; triflic acid; 2,6-xylenol Formula: C29H45F3LaO8S MolecularWeight: 749.62851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)O.CC1=C(C(=CC=C1)C)O.C1CCOC1.C1CCOC1.C1CCOC1.C(F)(F)(F)S(=O)(=O)O.[La]

Isomeric SMILES

CC1=C(C(=CC=C1)C)O.CC1=C(C(=CC=C1)C)O.C1CCOC1.C1CCOC1.C1CCOC1.C(F)(F)(F)S(=O)(=O)O.[La]

InChI

InChI=1S/2C8H10O.3C4H8O.CHF3O3S.La/c2*1-6-4-3-5-7(2)8(6)9;3*1-2-4-5-3-1;2-1(3,4)8(5,6)7;/h2*3-5,9H,1-2H3;3*1-4H2;(H,5,6,7);