Chem
J-GLOBAL ID：200907022075883068   Nikkaji number：J556.814E

NS-102

NS-102
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： C12H13N2[N+]O3[O-]
Molecular formula furigana： C12-H13-N3-O4
Molecular weight： 263.253
InChI： InChI=1S/C12H13N3O4/c16-12-11(14-17)8-5-9(15(18)19)6-3-1-2-4-7(6)10(8)13-12/h5-7,17H,1-4H2,(H,13,14,16)
InChI key： UTZDLQPCQCBVNV-UHFFFAOYSA-N
SMILES： ON=C1C(=O)NC2=C1C=C(C1CCCCC21)[N+](=O)[O-]
Systematic name  (3)：
  • 5a,6,7,8,9,9a-ヘキサヒドロ-3-(ヒドロキシイミノ)-5-ニトロ-1H-ベンゾ[g]インドール-2(3H)-オン
  • 3-(ヒドロキシイミノ)-5-ニトロ-1H,2H,3H,5aH,6H,7H,8H,9H,9aH-シクロヘキサ[g]インドール-2-オン
  • 3-(hydroxyimino)-5-nitro-1H,2H,3H,5aH,6H,7H,8H,9H,9aH-cyclohexa[g]indol-2-one
Other name (2)：
  • NS-102
  • 5a,6,7,8,9,9a-Hexahydro-3-(hydroxyimino)-5-nitro-1H-benz[g]indol-2(3H)-one
KEGG COMPOUND： C13731
Thsaurus map：
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