Chem
J-GLOBAL ID:200907092423982359
Nikkaji number:J424.761B
(1β,5β,8-anti)-8-Methyl-3β-[4-trifluoromethylphenyl]-8-azabicyclo[3.2.1]octane-2β-carboxylic acid methyl ester
(1β,5β,8-anti)-8-メチル-3β-[4-トリフルオロメチルフェニル]-8-アザビシクロ[3.2.1]オクタン-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:
C17 H20 F3 NO2
Molecular formula furigana:
C17-H20-F3-N-O2
Molecular weight:
327.347
InChI:
InChI=1S/C17H20F3NO2/c1-21-12-7-8-14(21)15(16(22)23-2)13(9-12)10-3-5-11(6-4-10)17(18,19)20/h3-6,12-15H,7-9H2,1-2H3/t12-,13+,14+,15-/m0/s1
InChI key:
YDHBZQLWPITXGF-YJNKXOJESA-N
SMILES:
COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1c1ccc(cc1)C(F)(F)F)N2C
Systematic name (1):
(1β,5β,8-anti)-8-メチル-3β-[4-トリフルオロメチルフェニル]-8-アザビシクロ[3.2.1]オクタン-2β-カルボン酸メチル
Other name (1):
(1β,5β,8-anti)-8-Methyl-3β-[4-trifluoromethylphenyl]-8-azabicyclo[3.2.1]octane-2β-carboxylic acid methyl ester
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