Chem
J-GLOBAL ID:200907027520154979   Nikkaji number:J241.980G

Bis[2-chloro-5-methyl-3-[[3-[[(4-methoxyphenyl)amino]carbonyl]-2-hydroxy-1-naphthyl]azo]benzenesulfonic acid]barium salt

ビス[2-クロロ-5-メチル-3-[[3-[[(4-メトキシフェニル)アミノ]カルボニル]-2-ヒドロキシ-1-ナフチル]アゾ]ベンゼンスルホン酸]バリウム
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C50H38BaCl2N6O12S2
Molecular formula furigana: C50-H38-BA-CL2-N6-O12-S2
Molecular weight: 1187.230
InChI: InChI=1S/2C25H20ClN3O6S.Ba/c2*1-14-11-20(22(26)21(12-14)36(32,33)34)28-29-23-18-6-4-3-5-15(18)13-19(24(23)30)25(31)27-16-7-9-17(35-2)10-8-16;/h2*3-13,30H,1-2H3,(H,27,31)(H,32,33,34);/q;;+2/p-2
InChI key: XLSFRBOVRODUAT-UHFFFAOYSA-L
SMILES: COc1ccc(NC(=O)c2cc3ccccc3c(N=Nc3cc(C)cc(c3Cl)S(=O)(=O)O[Ba]OS(=O)(=O)c3cc(C)cc(N=Nc4c(O)c(cc5ccccc45)C(=O)Nc4ccc(OC)cc4)c3Cl)c2O)cc1
Systematic name  (3):
  • ビス[2-クロロ-5-メチル-3-[[3-[[(4-メトキシフェニル)アミノ]カルボニル]-2-ヒドロキシ-1-ナフチル]アゾ]ベンゼンスルホン酸]バリウム
  • {[2-クロロ-3-(2-{2-ヒドロキシ-3-[(4-メトキシフェニル)カルバモイル]ナフタレン-1-イル}ジアゼン-1-イル)-5-メチルベンゼンスルホニル]オキシ}バリオ 2-クロロ-3-(2-{2-ヒドロキシ-3-[(4-メトキシフェニル)カルバモイル]ナフタレン-1-イル}ジアゼン-1-イル)-5-メチルベンゼン-1-スルホナート
  • {[2-chloro-3-(2-{2-hydroxy-3-[(4-methoxyphenyl)carbamoyl]naphthalen-1-yl}diazen-1-yl)-5-methylbenzenesulfonyl]oxy}bario 2-chloro-3-(2-{2-hydroxy-3-[(4-methoxyphenyl)carbamoyl]naphthalen-1-yl}diazen-1-yl)-5-methylbenzene-1-sulfonate
Other name (1):
  • Bis[2-chloro-5-methyl-3-[[3-[[(4-methoxyphenyl)amino]carbonyl]-2-hydroxy-1-naphthyl]azo]benzenesulfonic acid]barium salt
Regulation number (1):
  • (4)-1056
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