Catalog Number:
AG01FFLP
Chemical Name:
Dibenz[c,h]acridinium, 14-(4-ethoxy-4-oxobutyl)-5,6,8,9-tetrahydro-7-phenyl-, 1,1,1-trifluoromethanesulfonate (1:1)
CAS Number:
457602-08-3
Molecular Formula:
C34H32F3NO5S
Molecular Weight:
623.6818
MDL Number:
MFCD00961180
IUPAC Name:
ethyl 4-(13-phenyl-2-azoniapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1,3(12),4,6,8,13,17,19,21-nonaen-2-yl)butanoate;trifluoromethanesulfonate
InChI:
InChI=1S/C33H32NO2.CHF3O3S/c1-2-36-30(35)17-10-22-34-32-26-15-8-6-11-23(26)18-20-28(32)31(25-13-4-3-5-14-25)29-21-19-24-12-7-9-16-27(24)33(29)34;2-1(3,4)8(5,6)7/h3-9,11-16H,2,10,17-22H2,1H3;(H,5,6,7)/q+1;/p-1
InChI Key:
HJIMOSSPGOOLNV-UHFFFAOYSA-M
SMILES:
[O-]S(=O)(=O)C(F)(F)F.CCOC(=O)CCC[n+]1c2c3ccccc3CCc2c(c2c1c1ccccc1CC2)c1ccccc1
