Xylenol Orange

Monograph ID
M11551
Title
Xylenol Orange
Molecular formula
C31H32N2O13S
Molecular weight
672.66
Percent composition
C 55.35%, H 4.80%, N 4.16%, O 30.92%, S 4.77%
Standard InChI
InChI=1S/C31H32N2O13S/c1-17-7-19(9-21(30(17)42)11-32(13-25(34)35)14-26(36)37)29(23-5-3-4-6-24(23)47(44,45)46)20-8-18(2)31(43)22(10-20)12-33(15-27(38)39)16-28(40)41/h3-10,42H,11-16H2,1-2H3,(H,34,35)(H,36,37)(H,38,39)(H,40,41)(H,44,45,46)/b29-20-
Standard InChIKey
SESORLVFYDXIDP-BRPDVVIDSA-N

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