Chem
J-GLOBAL ID:200907009420911596
Nikkaji number:J777.897J
(1R,5S)-3α-(4-Fluorophenyl)tropane-2β-carboxylic acid methyl ester
(1R,5S)-3α-(4-フルオロフェニル)トロパン-2β-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-/m0/s1
InChI key:
QUSLQENMLDRCTO-XQLPTFJDSA-N
SMILES:
COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@H]1c1ccc(F)cc1)N2C
Systematic name (4):
(1R,5S)-3α-(4-フルオロフェニル)トロパン-2β-カルボン酸メチル
(1β,5β)-3α-(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-2β-カルボン酸メチル
メチル (1R,2S,3R,5S)-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 (1R,2S,3R,5S)-3-(4-fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
Other name (2):
(1R,5S)-3α-(4-Fluorophenyl)tropane-2β-carboxylic acid methyl ester
(1β,5β)-3α-(4-Fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2β-carboxylic acid methyl ester
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