Chem
J-GLOBAL ID:200907001658972495
Nikkaji number:J2.594.307D
2-[(3R)-2-(Phenylthiomethyl)-3α-methylcyclopentyl]propanoic acid methyl ester
2-[(3R)-2-(フェニルチオメチル)-3α-メチルシクロペンチル]プロパン酸メチル
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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 H24 O2 S
Molecular formula furigana:
C17-H24-O2-S
Molecular weight:
292.440
InChI:
InChI=1S/C17H24O2S/c1-12-9-10-15(13(2)17(18)19-3)16(12)11-20-14-7-5-4-6-8-14/h4-8,12-13,15-16H,9-11H2,1-3H3/t12-,13?,15?,16?/m1/s1
InChI key:
BCCDISQDMPPRCO-KHZFOJANSA-N
SMILES:
COC(=O)C(C)C1CC[C@@H](C)C1CSc1ccccc1
Systematic name (3):
2-[(3R)-2-(フェニルチオメチル)-3α-メチルシクロペンチル]プロパン酸メチル
メチル 2-[(3R)-3-メチル-2-[(フェニルスルファニル)メチル]シクロペンチル]プロパノアート
methyl 2-[(3R)-3-methyl-2-[(phenylsulfanyl)methyl]cyclopentyl]propanoate
Other name (1):
2-[(3R)-2-(Phenylthiomethyl)-3α-methylcyclopentyl]propanoic acid methyl ester
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