Chem
J-GLOBAL ID:200907099705271093   Nikkaji number:J501.131K

2-Nitro-4,5,7,8,9,10,11,12-octahydrobenzo[a]pyrene

2-ニトロ-4,5,7,8,9,10,11,12-オクタヒドロベンゾ[a]ピレン
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: C20H19[N+]O[O-]
Molecular formula furigana: C20-H19-N-O2
Molecular weight: 305.377
InChI: InChI=1S/C20H19NO2/c22-21(23)16-10-14-6-5-13-9-12-3-1-2-4-17(12)18-8-7-15(11-16)19(14)20(13)18/h9-11H,1-8H2
InChI key: YKDMOHKMDIVHQS-UHFFFAOYSA-N
SMILES: [O-][N+](=O)c1cc2CCc3cc4CCCCc4c4CCc(c1)c2c34
Systematic name  (3):
  • 2-ニトロ-4,5,7,8,9,10,11,12-オクタヒドロベンゾ[a]ピレン
  • 14-ニトロペンタシクロ[10.6.2.02,7.09,19.016,20]イコサ-1(19),2(7),8,12(20),13,15-ヘキサエン
  • 14-nitropentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),8,12(20),13,15-hexaene
Other name (1):
  • 2-Nitro-4,5,7,8,9,10,11,12-octahydrobenzo[a]pyrene
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