2-(2-cyclohexyl-1,4-dithian-1-ium-1-yl)ethanal; tris(fluoranyl)methanesulfonate

Systemtic Name: 2-(2-cyclohexyl-1,4-dithian-1-ium-1-yl)ethanal; tris(fluoranyl)methanesulfonate Openeye Name: 2-(2-cyclohexyl-1,4-dithian-1-ium-1-yl)acetaldehyde; trifluoromethanesulfonate CAS Name: 2-(2-cyclohexyl-1,4-dithian-1-ium-1-yl)acetaldehyde; trifluoromethanesulfonate IUPAC Name: 2-(2-cyclohexyl-1,4-dithian-1-ium-1-yl)acetaldehyde; trifluoromethanesulfonate Traditional Name: 2-(2-cyclohexyl-1,4-dithian-1-ium-1-yl)acetaldehyde triflate Formula: C13H21F3O4S3 MolecularWeight: 394.49365

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CSCC[S+]2CC=O.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2CSCC[S+]2CC=O.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C12H21OS2.CHF3O3S/c13-6-8-15-9-7-14-10-12(15)11-4-2-1-3-5-11;2-1(3,4)8(5,6)7/h6,11-12H,1-5,7-10H2;(H,5,6,7)/q+1;/p-1