2-[5-(3,3-dimethyl-1-octadecylindol-2-ylidene)penta-1,3-dien-1-yl]-3,3-dimethyl-1-octadecylindol-1-ium perchlorate ion

CAS: 127274-91-3

Formula: C61H99ClN2O4

SMILES: [O-][Cl](=O)(=O)=O.CCCCCCCCCCCCCCCCCCN1C2=C(C=CC=C2)C(C)(C)C1=CC=CC=CC1=[N+](CCCCCCCCCCCCCCCCCC)C2=C(C=CC=C2)C1(C)C

IUPAC: 2-[5-(3,3-dimethyl-1-octadecyl-2,3-dihydro-1H-indol-2-ylidene)penta-1,3-dien-1-yl]-3,3-dimethyl-1-octadecyl-3H-indol-1-ium perchlorate

InChI: InChI=1S/C61H99N2.ClHO4/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-44-52-62-56-48-42-40-46-54(56)60(3,4)58(62)50-38-37-39-51-59-61(5,6)55-47-41-43-49-57(55)63(59)53-45-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2;2-1(3,4)5/h37-43,46-51H,7-36,44-45,52-53H2,1-6H3;(H,2,3,4,5)/q+1;/p-1

Composition: C (76.33%), H (10.40%), Cl (3.69%), N (2.92%), O (6.67%)

Molar Mass: 959.92

Atom Count: 167

Heavy Atom Count: 68