Chem
J-GLOBAL ID：200907001556731663   Nikkaji number：J1.022.759C

(1E,2S)-2β-Allyl-4β-phenylcyclohexanone O-(2,4-dinitrophenyl)oxime

(1E,2S)-2β-アリル-4β-フェニルシクロヘキサノンO-(2,4-ジニトロフェニル)オキシム
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： C21H21N[N+]2O3[O-]2
Molecular formula furigana： C21-H21-N3-O5
Molecular weight： 395.415
InChI： InChI=1S/C21H21N3O5/c1-2-6-17-13-16(15-7-4-3-5-8-15)9-11-19(17)22-29-21-12-10-18(23(25)26)14-20(21)24(27)28/h2-5,7-8,10,12,14,16-17H,1,6,9,11,13H2/b22-19+/t16-,17-/m0/s1
InChI key： BKEHOEMTXYEIKX-XWGOGYMWSA-N
SMILES： [O-][N+](=O)c1ccc(O/N=C/2\CC[C@@H](C[C@@H]2CC=C)c2ccccc2)c(c1)[N+](=O)[O-]
Systematic name  (3)：
  • (1E,2S)-2β-アリル-4β-フェニルシクロヘキサノンO-(2,4-ジニトロフェニル)オキシム
  • (1E,2S,4S)-N-(2,4-ジニトロフェノキシ)-4-フェニル-2-(プロパ-2-エン-1-イル)シクロヘキサン-1-イミン
  • (1E,2S,4S)-N-(2,4-dinitrophenoxy)-4-phenyl-2-(prop-2-en-1-yl)cyclohexan-1-imine
Other name (1)：
  • (1E,2S)-2β-Allyl-4β-phenylcyclohexanone O-(2,4-dinitrophenyl)oxime
Thsaurus map：
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