Chem
J-GLOBAL ID:200907025642314460   Nikkaji number:J2.145.313G

2-(4-Methoxyphenyl)-3-methyl-4-(ethoxycarbonyl)-2-azoniabicyclo[2.2.1]hepta-2-ene

2-(4-メトキシフェニル)-3-メチル-4-(エトキシカルボニル)-2-アゾニアビシクロ[2.2.1]ヘプタ-2-エン
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: C17H22[N+]O3
Molecular formula furigana: C17-H22-N-O3
Molecular weight: 288.366
InChI: InChI=1S/C17H22NO3/c1-4-21-16(19)17-10-9-14(11-17)18(12(17)2)13-5-7-15(20-3)8-6-13/h5-8,14H,4,9-11H2,1-3H3/q+1
InChI key: IERYLDOWSUMMIU-UHFFFAOYSA-N
SMILES: CCOC(=O)C12CCC(C1)[N+](=C2C)c1ccc(OC)cc1
Systematic name  (3):
  • 2-(4-メトキシフェニル)-3-メチル-4-(エトキシカルボニル)-2-アゾニアビシクロ[2.2.1]ヘプタ-2-エン
  • 4-(エトキシカルボニル)-2-(4-メトキシフェニル)-3-メチル-2λ5-アザビシクロ[2.2.1]ヘプタ-2-エン-2-イリウム
  • 4-(ethoxycarbonyl)-2-(4-methoxyphenyl)-3-methyl-2λ5-azabicyclo[2.2.1]hept-2-en-2-ylium
Other name (1):
  • 2-(4-Methoxyphenyl)-3-methyl-4-(ethoxycarbonyl)-2-azoniabicyclo[2.2.1]hepta-2-ene
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