2-(2,6-ditert-butylpyran-4-ylidene)ethylidene-dimethyl-azanium; tris(fluoranyl)methanesulfonate

Systemtic Name: 2-(2,6-ditert-butylpyran-4-ylidene)ethylidene-dimethyl-azanium; tris(fluoranyl)methanesulfonate Openeye Name: 2-(2,6-ditert-butylpyran-4-ylidene)ethylidene-dimethyl-ammonium; trifluoromethanesulfonate CAS Name: 2-(2,6-ditert-butyl-4-pyranylidene)ethylidene-dimethylammonium; trifluoromethanesulfonate IUPAC Name: 2-(2,6-ditert-butylpyran-4-ylidene)ethylidene-dimethylazanium; trifluoromethanesulfonate Traditional Name: 2-(2,6-ditert-butylpyran-4-ylidene)ethylidene-dimethyl-ammonium triflate Formula: C18H28F3NO4S MolecularWeight: 411.47943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC=[N+](C)C)C=C(O1)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=CC=[N+](C)C)C=C(O1)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C17H28NO.CHF3O3S/c1-16(2,3)14-11-13(9-10-18(7)8)12-15(19-14)17(4,5)6;2-1(3,4)8(5,6)7/h9-12H,1-8H3;(H,5,6,7)/q+1;/p-1