Catalog Number:
AG01EXH2
Chemical Name:
2,4,6-Triphenyl-1-(piperidin-4-ylmethyl)pyridin-1-ium trifluoromethanesulfonate
CAS Number:
80254-14-4
Molecular Formula:
C30H29F3N2O3S
Molecular Weight:
554.6231
MDL Number:
MFCD00960883
IUPAC Name:
trifluoromethanesulfonate;2,4,6-triphenyl-1-(piperidin-4-ylmethyl)pyridin-1-ium
InChI:
InChI=1S/C29H29N2.CHF3O3S/c1-4-10-24(11-5-1)27-20-28(25-12-6-2-7-13-25)31(22-23-16-18-30-19-17-23)29(21-27)26-14-8-3-9-15-26;2-1(3,4)8(5,6)7/h1-15,20-21,23,30H,16-19,22H2;(H,5,6,7)/q+1;/p-1
InChI Key:
NTVKPDDJDGODOI-UHFFFAOYSA-M
SMILES:
N1CCC(CC1)C[n+]1c(cc(cc1c1ccccc1)c1ccccc1)c1ccccc1.[O-]S(=O)(=O)C(F)(F)F
