(phenylmethyl) 1-methylimidazole-2-carboxylate; tris(fluoranyl)methanesulfonate

Systemtic Name: (phenylmethyl) 1-methylimidazole-2-carboxylate; tris(fluoranyl)methanesulfonate Openeye Name: benzyl 1-methylimidazole-2-carboxylate; trifluoromethanesulfonate CAS Name: 1-methyl-2-imidazolecarboxylic acid (phenylmethyl) ester; trifluoromethanesulfonate IUPAC Name: benzyl 1-methylimidazole-2-carboxylate; trifluoromethanesulfonate Traditional Name: 1-methylimidazole-2-carboxylic acid benzyl ester triflate Formula: C13H12F3N2O5S- MolecularWeight: 365.30499

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)OCC2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CN1C=CN=C1C(=O)OCC2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C12H12N2O2.CHF3O3S/c1-14-8-7-13-11(14)12(15)16-9-10-5-3-2-4-6-10;2-1(3,4)8(5,6)7/h2-8H,9H2,1H3;(H,5,6,7)/p-1