3,3-dimethylbut-1-ynyl(triphenyl)phosphanium; tris(fluoranyl)methanesulfonic acid

Systemtic Name: 3,3-dimethylbut-1-ynyl(triphenyl)phosphanium; tris(fluoranyl)methanesulfonic acid Openeye Name: 3,3-dimethylbut-1-ynyl(triphenyl)phosphonium; trifluoromethanesulfonic acid CAS Name: 3,3-dimethylbut-1-ynyl(triphenyl)phosphonium; trifluoromethanesulfonic acid IUPAC Name: 3,3-dimethylbut-1-ynyl(triphenyl)phosphanium; trifluoromethanesulfonic acid Traditional Name: 3,3-dimethylbut-1-ynyl(triphenyl)phosphonium; triflic acid Formula: C25H25F3O3PS+ MolecularWeight: 493.498171

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)O

Isomeric SMILES

CC(C)(C)C#C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)O

InChI

InChI=1S/C24H24P.CHF3O3S/c1-24(2,3)19-20-25(21-13-7-4-8-14-21,22-15-9-5-10-16-22)23-17-11-6-12-18-23;2-1(3,4)8(5,6)7/h4-18H,1-3H3;(H,5,6,7)/q+1;