Chem
J-GLOBAL ID：200907075755106704   Nikkaji number：J218.352H

9-(2-Carboxylatophenyl)-3,6-bis(diethylamino)xanthylium

9-(2-カルボキシラトフェニル)-3,6-ビス(ジエチルアミノ)キサンチリウム
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： C28H30N2O[O-][O+]
Molecular formula furigana： C28-H30-N2-O3
Molecular weight： 442.559
InChI： InChI=1S/C28H30N2O3/c1-5-29(6-2)19-13-15-23-25(17-19)33-26-18-20(30(7-3)8-4)14-16-24(26)27(23)21-11-9-10-12-22(21)28(31)32/h9-18H,5-8H2,1-4H3
InChI key： CVAVMIODJQHEEH-UHFFFAOYSA-N
SMILES： CCN(CC)c1ccc2c(c3ccccc3C(=O)[O-])c3ccc(cc3[o+]c2c1)N(CC)CC
Systematic name  (3)：
  • 9-(2-カルボキシラトフェニル)-3,6-ビス(ジエチルアミノ)キサンチリウム
  • 9-(2-カルボキシラトフェニル)-3,6-ビス(ジエチルアミノ)-10λ4-キサンテン-10-イリウム
  • 9-(2-carboxylatophenyl)-3,6-bis(diethylamino)-10λ4-xanthen-10-ylium
Other name (1)：
  • 9-(2-Carboxylatophenyl)-3,6-bis(diethylamino)xanthylium
CAS registry number： 3375-25-5
Regulation number (2)：
  • EINECS2221639
  • TSCA(3375-25-5)
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