Chem
J-GLOBAL ID：200907023812441710
Nikkaji number：J2.588.391H
(4S)-1-(4-Methoxybenzyl)-3,3-difluoro-4α-isopropylazetidine-2-one
(4S)-1-(4-メトキシベンジル)-3,3-ジフルオロ-4α-イソプロピルアゼチジン-2-オン
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： C14H17F2NO2
Molecular formula furigana： C14-H17-F2-N-O2
Molecular weight： 269.292
InChI：
InChI=1S/C14H17F2NO2/c1-9(2)12-14(15,16)13(18)17(12)8-10-4-6-11(19-3)7-5-10/h4-7,9,12H,8H2,1-3H3/t12-/m0/s1
InChI key：
ZSUBIXFROBKVPL-LBPRGKRZSA-N
SMILES：
COc1ccc(CN2[C@@H](C(C)C)C(F)(F)C2=O)cc1
Systematic name (3)：
- (4S)-1-(4-メトキシベンジル)-3,3-ジフルオロ-4α-イソプロピルアゼチジン-2-オン
- (4S)-3,3-ジフルオロ-1-[(4-メトキシフェニル)メチル]-4-(プロパン-2-イル)アゼチジン-2-オン
- (4S)-3,3-difluoro-1-[(4-methoxyphenyl)methyl]-4-(propan-2-yl)azetidin-2-one
- (4S)-1-(4-Methoxybenzyl)-3,3-difluoro-4α-isopropylazetidine-2-one
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