Chem
J-GLOBAL ID:200907027019615893   Nikkaji number:J219.360D

3-Chloro-2-methyl-5-[[3-[[(3-chloro-4-ethoxyphenyl)amino]carbonyl]-2-hydroxy-1-naphthyl]azo]benzenesulfonic acid sodium salt

3-クロロ-2-メチル-5-[[3-[[(3-クロロ-4-エトキシフェニル)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ナトリウム
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: C26H20Cl2N3NaO6S
Molecular formula furigana: C26-H20-CL2-N3-NA-O6-S
Molecular weight: 596.410
InChI: InChI=1S/C26H21Cl2N3O6S.Na/c1-3-37-22-9-8-16(11-21(22)28)29-26(33)19-10-15-6-4-5-7-18(15)24(25(19)32)31-30-17-12-20(27)14(2)23(13-17)38(34,35)36;/h4-13,32H,3H2,1-2H3,(H,29,33)(H,34,35,36);/q;+1/p-1
InChI key: FFGNPRKEXYOAPA-UHFFFAOYSA-M
SMILES: CCOc1ccc(NC(=O)c2cc3ccccc3c(N=Nc3cc(Cl)c(C)c(c3)S(=O)(=O)O[Na])c2O)cc1Cl
Systematic name  (3):
  • 3-クロロ-2-メチル-5-[[3-[[(3-クロロ-4-エトキシフェニル)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ナトリウム
  • ナトリウム 3-クロロ-5-(2-{3-[(3-クロロ-4-エトキシフェニル)カルバモイル]-2-ヒドロキシナフタレン-1-イル}ジアゼン-1-イル)-2-メチルベンゼン-1-スルホナート
  • sodium 3-chloro-5-(2-{3-[(3-chloro-4-ethoxyphenyl)carbamoyl]-2-hydroxynaphthalen-1-yl}diazen-1-yl)-2-methylbenzene-1-sulfonate
Other name (1):
  • 3-Chloro-2-methyl-5-[[3-[[(3-chloro-4-ethoxyphenyl)amino]carbonyl]-2-hydroxy-1-naphthyl]azo]benzenesulfonic acid sodium salt
Regulation number (1):
  • (4)-1061
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