Chem
J-GLOBAL ID:200907018662126540   Nikkaji number:J2.169.389H

2-Oxo-1-(4-nitrophenyl)-1,2,3,6-tetrahydro-1,4-diazepino[6,5-b]indole 4-oxide

2-オキソ-1-(4-ニトロフェニル)-1,2,3,6-テトラヒドロ-1,4-ジアゼピノ[6,5-b]インドール4-オキシド
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: C17H12N2[N+]2O2[O-]2
Molecular formula furigana: C17-H12-N4-O4
Molecular weight: 336.307
InChI: InChI=1S/C17H12N4O4/c22-16-10-19(23)9-15-17(13-3-1-2-4-14(13)18-15)20(16)11-5-7-12(8-6-11)21(24)25/h1-9,18H,10H2
InChI key: YGIVIBOYUKPNKV-UHFFFAOYSA-N
SMILES: [O-][N+](=O)c1ccc(cc1)N1c2c(C=[N+]([O-])CC1=O)[nH]c1ccccc21
Systematic name  (3):
  • 2-オキソ-1-(4-ニトロフェニル)-1,2,3,6-テトラヒドロ-1,4-ジアゼピノ[6,5-b]インドール4-オキシド
  • 1-(4-ニトロフェニル)-2-オキソ-1H,2H,3H,6H-[1,4]ジアゼピノ[6,5-b]インドール-4-イウム-4-オラート
  • 1-(4-nitrophenyl)-2-oxo-1H,2H,3H,6H-[1,4]diazepino[6,5-b]indol-4-ium-4-olate
Other name (1):
  • 2-Oxo-1-(4-nitrophenyl)-1,2,3,6-tetrahydro-1,4-diazepino[6,5-b]indole 4-oxide
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