Chem
J-GLOBAL ID：200907040533897748   Nikkaji number：J245.612E

3,6-Diamino-9-[2-(methoxycarbonyl)phenyl]xanthylium

3,6-ジアミノ-9-[2-(メトキシカルボニル)フェニル]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： C21H17N2O2[O+]
Molecular formula furigana： C21-H17-N2-O3
Molecular weight： 345.377
InChI： InChI=1S/C21H17N2O3/c1-25-21(24)15-5-3-2-4-14(15)20-16-8-6-12(22)10-18(16)26-19-11-13(23)7-9-17(19)20/h2-11H,22-23H2,1H3/q+1
InChI key： ZWODABSNRKVFCK-UHFFFAOYSA-N
SMILES： COC(=O)c1ccccc1c1c2ccc(N)cc2[o+]c2cc(N)ccc12
Systematic name  (3)：
  • 3,6-ジアミノ-9-[2-(メトキシカルボニル)フェニル]キサンチリウム
  • 3,6-ジアミノ-9-[2-(メトキシカルボニル)フェニル]-10λ4-キサンテン-10-イリウム
  • 3,6-diamino-9-[2-(methoxycarbonyl)phenyl]-10λ4-xanthen-10-ylium
Other name (1)：
  • 3,6-Diamino-9-[2-(methoxycarbonyl)phenyl]xanthylium
Thsaurus map：
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