Chem
J-GLOBAL ID:200907048902879601   Nikkaji number:J1.530.392A

(1R)-1-Nitro-3,4-dimethyl-6α-formyl-3-cyclohexene-1β-propionic acid methyl ester

(1R)-1-ニトロ-3,4-ジメチル-6α-ホルミル-3-シクロヘキセン-1β-プロピオン酸メチル
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: C13H19[N+]O4[O-]
Molecular formula furigana: C13-H19-N-O5
Molecular weight: 269.297
InChI: InChI=1S/C13H19NO5/c1-9-6-11(8-15)13(14(17)18,7-10(9)2)5-4-12(16)19-3/h8,11H,4-7H2,1-3H3/t11-,13-/m1/s1
InChI key: OEYVSAMZAFNNJA-DGCLKSJQSA-N
SMILES: COC(=O)CC[C@]1(CC(=C(C)C[C@@H]1C=O)C)[N+](=O)[O-]
Systematic name  (3):
  • (1R)-1-ニトロ-3,4-ジメチル-6α-ホルミル-3-シクロヘキセン-1β-プロピオン酸メチル
  • メチル 3-[(1R,6S)-6-ホルミル-3,4-ジメチル-1-ニトロシクロヘキサ-3-エン-1-イル]プロパノアート
  • methyl 3-[(1R,6S)-6-formyl-3,4-dimethyl-1-nitrocyclohex-3-en-1-yl]propanoate
Other name (1):
  • (1R)-1-Nitro-3,4-dimethyl-6α-formyl-3-cyclohexene-1β-propionic acid methyl ester
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