methylbenzene; tris(fluoranyl)methanesulfonic acid

Systemtic Name: methylbenzene; tris(fluoranyl)methanesulfonic acid Openeye Name: toluene; trifluoromethanesulfonic acid CAS Name: toluene; trifluoromethanesulfonic acid IUPAC Name: toluene; trifluoromethanesulfonic acid Traditional Name: toluene; triflic acid Formula: C8H9F3O3S MolecularWeight: 242.21547

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)O

Isomeric SMILES

CC1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)O

InChI

InChI=1S/C7H8.CHF3O3S/c1-7-5-3-2-4-6-7;2-1(3,4)8(5,6)7/h2-6H,1H3;(H,5,6,7)