Chem
J-GLOBAL ID：200907021299818010   Nikkaji number：J1.705.605K

2-(2-Bromo-5-methoxyphenethyl)-3-(nitromethyl)cyclohexanone

2-(2-ブロモ-5-メトキシフェネチル)-3-(ニトロメチル)シクロヘキサノン
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： C16H20Br[N+]O3[O-]
Molecular formula furigana： C16-H20-BR-N-O4
Molecular weight： 370.243
InChI： InChI=1S/C16H20BrNO4/c1-22-13-6-8-15(17)11(9-13)5-7-14-12(10-18(20)21)3-2-4-16(14)19/h6,8-9,12,14H,2-5,7,10H2,1H3
InChI key： VDEKKECPAWGDOB-UHFFFAOYSA-N
SMILES： COc1ccc(Br)c(CCC2C(C[N+](=O)[O-])CCCC2=O)c1
Systematic name  (3)：
  • 2-(2-ブロモ-5-メトキシフェネチル)-3-(ニトロメチル)シクロヘキサノン
  • 2-[2-(2-ブロモ-5-メトキシフェニル)エチル]-3-(ニトロメチル)シクロヘキサン-1-オン
  • 2-[2-(2-bromo-5-methoxyphenyl)ethyl]-3-(nitromethyl)cyclohexan-1-one
Other name (1)：
  • 2-(2-Bromo-5-methoxyphenethyl)-3-(nitromethyl)cyclohexanone
Thsaurus map：
Thesaurus Map

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