Chem
J-GLOBAL ID：200907064980008124   Nikkaji number：J404.563G

4-Nitrobenzoic acid (4β-ethyl-2β-methoxy-4-methyltetrahydrofuran)-3α-yl ester

4-ニトロ安息香酸(4β-エチル-2β-メトキシ-4-メチルテトラヒドロフラン)-3α-イル
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： C15H19[N+]O5[O-]
Molecular formula furigana： C15-H19-N-O6
Molecular weight： 309.318
InChI： InChI=1S/C15H19NO6/c1-4-15(2)9-21-14(20-3)12(15)22-13(17)10-5-7-11(8-6-10)16(18)19/h5-8,12,14H,4,9H2,1-3H3/t12-,14+,15-/m0/s1
InChI key： ZDGKNAAEFVLGFT-CFVMTHIKSA-N
SMILES： CC[C@@]1(C)CO[C@@H](OC)[C@@H]1OC(=O)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (3)：
  • 4-ニトロ安息香酸(4β-エチル-2β-メトキシ-4-メチルテトラヒドロフラン)-3α-イル
  • (2R,3R,4S)-4-エチル-2-メトキシ-4-メチルオキソラン-3-イル 4-ニトロベンゾアート
  • (2R,3R,4S)-4-ethyl-2-methoxy-4-methyloxolan-3-yl 4-nitrobenzoate
Other name (1)：
  • 4-Nitrobenzoic acid (4β-ethyl-2β-methoxy-4-methyltetrahydrofuran)-3α-yl ester
Thsaurus map：
Thesaurus Map

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