Catalog Number:
AG01EOPF
Chemical Name:
Phen-DC3 Trifluoromethanesulfonate
CAS Number:
929895-45-4
Molecular Formula:
C36H26F6N6O8S2
Molecular Weight:
848.7475
MDL Number:
MFCD31560493
IUPAC Name:
2-N,9-N-bis(1-methylquinolin-1-ium-3-yl)-1,10-phenanthroline-2,9-dicarboxamide;trifluoromethanesulfonate
InChI:
InChI=1S/C34H24N6O2.2CHF3O3S/c1-39-19-25(17-23-7-3-5-9-29(23)39)35-33(41)27-15-13-21-11-12-22-14-16-28(38-32(22)31(21)37-27)34(42)36-26-18-24-8-4-6-10-30(24)40(2)20-26;2*2-1(3,4)8(5,6)7/h3-20H,1-2H3;2*(H,5,6,7)
InChI Key:
PYJCATLYPXPYHF-UHFFFAOYSA-N
SMILES:
[O-]S(=O)(=O)C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F.O=C(c1ccc2c(n1)c1nc(ccc1cc2)C(=O)Nc1c[n+](C)c2c(c1)cccc2)Nc1c[n+](C)c2c(c1)cccc2
