Chem
J-GLOBAL ID:200907099145842855
Nikkaji number:J1.706.509B
3,8-Diamino-5-(8-azidooctyl)-6-phenylphenanthridinium
3,8-ジアミノ-5-(8-アジドオクチル)-6-フェニルフェナントリジニウム
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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:
C27 H31 N3 [N-][N+]2
Molecular formula furigana:
C27-H31-N6
Molecular weight:
439.586
InChI:
InChI=1S/C27H30N6/c28-21-12-14-23-24-15-13-22(29)19-26(24)33(17-9-4-2-1-3-8-16-31-32-30)27(25(23)18-21)20-10-6-5-7-11-20/h5-7,10-15,18-19,29H,1-4,8-9,16-17,28H2/p+1
InChI key:
KOEDJOGPYOCLKS-UHFFFAOYSA-O
SMILES:
Nc1ccc2c(c1)c(c1ccccc1)[n+](CCCCCCCCN=[N+]=[N-])c1cc(N)ccc21
Systematic name (3):
3,8-ジアミノ-5-(8-アジドオクチル)-6-フェニルフェナントリジニウム
3,8-ジアミノ-5-(8-アジドオクチル)-6-フェニルフェナントリジン-5-イウム
3,8-diamino-5-(8-azidooctyl)-6-phenylphenanthridin-5-ium
Other name (1):
3,8-Diamino-5-(8-azidooctyl)-6-phenylphenanthridinium
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