Chem
J-GLOBAL ID:200907074709322676
Nikkaji number:J1.145.414C
(2S,4S)-4-Phenyl-4-methoxy-2-(cyclohexylmethyl)butyric acid ethyl ester
(2S,4S)-4-フェニル-4-メトキシ-2-(シクロヘキシルメチル)酪酸エチル
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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:
C20 H30 O3
Molecular formula furigana:
C20-H30-O3
Molecular weight:
318.457
InChI:
InChI=1S/C20H30O3/c1-3-23-20(21)18(14-16-10-6-4-7-11-16)15-19(22-2)17-12-8-5-9-13-17/h5,8-9,12-13,16,18-19H,3-4,6-7,10-11,14-15H2,1-2H3/t18-,19-/m0/s1
InChI key:
FSWTWOMEDIIJES-OALUTQOASA-N
SMILES:
CCOC(=O)[C@H](C[C@H](OC)c1ccccc1)CC1CCCCC1
Systematic name (3):
(2S,4S)-4-フェニル-4-メトキシ-2-(シクロヘキシルメチル)酪酸エチル
エチル (2S,4S)-2-(シクロヘキシルメチル)-4-メトキシ-4-フェニルブタノアート
ethyl (2S,4S)-2-(cyclohexylmethyl)-4-methoxy-4-phenylbutanoate
Other name (1):
(2S,4S)-4-Phenyl-4-methoxy-2-(cyclohexylmethyl)butyric acid ethyl ester
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