Chem
J-GLOBAL ID：200907073713379074
Nikkaji number：J424.769H
(1β,5β,8-anti)-8-Methyl-3β-[4-iodophenyl]-8-azabicyclo[3.2.1]octane-2β-carboxylic acid methyl ester
(1β,5β,8-anti)-8-メチル-3β-[4-ヨードフェニル]-8-アザビシクロ[3.2.1]オクタン-2β-カルボン酸メチル
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
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
Molecular formula： C16H20INO2
Molecular formula furigana： C16-H20-I-N-O2
Molecular weight： 385.245
InChI：
InChI=1S/C16H20INO2/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：
SIIICDNNMDMWCI-YJNKXOJESA-N
SMILES：
COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1c1ccc(I)cc1)N2C
Systematic name (2)：
- (1R,5S,8-anti)-3β-(4-ヨードフェニル)-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
- (1β,5β,8-anti)-8-メチル-3β-[4-ヨードフェニル]-8-アザビシクロ[3.2.1]オクタン-2β-カルボン酸メチル
- (1β,5β,8-anti)-8-Methyl-3β-[4-iodophenyl]-8-azabicyclo[3.2.1]octane-2β-carboxylic acid methyl ester
- (1R,5S,8-anti)-3β-(4-Iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2β-carboxylic acid methyl ester
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