Chem
J-GLOBAL ID:200907062231337658
Nikkaji number:J2.563.988J
(1α,5α)-3β-(4-Fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2α-carboxylic acid methyl ester
(1α,5α)-3β-(4-フルオロフェニル)-8-メチル-8-アザビシクロ[3.2.1]オクタン-2α-カルボン酸メチル
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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:
C16 H20 FNO2
Molecular formula furigana:
C16-H20-F-N-O2
Molecular weight:
277.339
InChI:
InChI=1S/C16H20FNO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15-/m1/s1
InChI key:
QUSLQENMLDRCTO-APIJFGDWSA-N
SMILES:
COC(=O)[C@H]1[C@@H]2CC[C@H](C[C@@H]1c1ccc(F)cc1)N2C
Systematic name (3):
(1α,5α)-3β-(4-フルオロフェニル)-8-メチル-8-アザビシクロ[3.2.1]オクタン-2α-カルボン酸メチル
メチル (1S,2R,3S,5R)-3-(4-フルオロフェニル)-8-メチル-8-アザビシクロ[3.2.1]オクタン-2-カルボキシラート
methyl (1S,2R,3S,5R)-3-(4-fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
Other name (1):
(1α,5α)-3β-(4-Fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2α-carboxylic acid methyl ester
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