Analyte Name

9-(2-((2-(Acetoxymethoxy)-2-oxoethyl)(methyl)carbamoyl)-5-((E)-4-((E)-4-(diethylamino)-2-methoxystyryl)styryl)phenyl)-3,6-bis(dimethylamino) Xanthylium

Molecular Formula

C51 H55 N4 O7

Molecular Weight

836.005

Accurate Mass

835.407

SMILES

CCN(CC)c1ccc(\C=C\c2ccc(\C=C\c3ccc(C(=O)N(C)CC(=O)OCOC(=O)C)c(c3)c4c5ccc(cc5[o+]c6cc(ccc46)N(C)C)N(C)C)cc2)c(OC)c1

InChI

InChI=1S/C51H55N4O7/c1-10-55(11-2)41-22-21-38(46(31-41)59-9)20-18-36-14-12-35(13-15-36)16-17-37-19-25-42(51(58)54(8)32-49(57)61-33-60-34(3)56)45(28-37)50-43-26-23-39(52(4)5)29-47(43)62-48-30-40(53(6)7)24-27-44(48)50/h12-31H,10-11,32-33H2,1-9H3/q+1/b17-16+,20-18+

IUPAC

acetyloxymethyl 2-[[2-[3,6-bis(dimethylamino)xanthen-10-ium-9-yl]-4-[(E)-2-[4-[(E)-2-[4-(diethylamino)-2-methoxyphenyl]ethenyl]phenyl]ethenyl]benzoyl]-methylamino]acetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat