methyl 4,6-diphenylpyrylium-2-carboxylate; tris(fluoranyl)methanesulfonate

Systemtic Name: methyl 4,6-diphenylpyrylium-2-carboxylate; tris(fluoranyl)methanesulfonate Openeye Name: methyl 4,6-diphenylpyrylium-2-carboxylate; trifluoromethanesulfonate CAS Name: 4,6-diphenyl-2-pyryliumcarboxylic acid methyl ester; trifluoromethanesulfonate IUPAC Name: methyl 4,6-diphenylpyrylium-2-carboxylate; trifluoromethanesulfonate Traditional Name: 4,6-diphenylpyrylium-2-carboxylic acid methyl ester triflate Formula: C20H15F3O6S MolecularWeight: 440.38971

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=[O+]1)C2=CC=CC=C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=[O+]1)C2=CC=CC=C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C19H15O3.CHF3O3S/c1-21-19(20)18-13-16(14-8-4-2-5-9-14)12-17(22-18)15-10-6-3-7-11-15;2-1(3,4)8(5,6)7/h2-13H,1H3;(H,5,6,7)/q+1;/p-1