Chem
J-GLOBAL ID：201107001790436592   Nikkaji number：J2.926.766I

WS-12

(1R,2S,5R)-2-イソプロピル-N-(4-メトキシフェニル)-5-メチルシクロヘキサンカルボアミド
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： C18H27NO2
Molecular formula furigana： C18-H27-N-O2
Molecular weight： 289.419
InChI： InChI=1S/C18H27NO2/c1-12(2)16-10-5-13(3)11-17(16)18(20)19-14-6-8-15(21-4)9-7-14/h6-9,12-13,16-17H,5,10-11H2,1-4H3,(H,19,20)/t13-,16+,17-/m1/s1
InChI key： HNSGVPAAXJJOPQ-XOKHGSTOSA-N
SMILES： COc1ccc(NC(=O)[C@@H]2C[C@H](C)CC[C@H]2C(C)C)cc1
Systematic name  (3)：
  • (1R,2S,5R)-2-イソプロピル-N-(4-メトキシフェニル)-5-メチルシクロヘキサンカルボアミド
  • (1R,2S,5R)-N-(4-メトキシフェニル)-5-メチル-2-(プロパン-2-イル)シクロヘキサン-1-カルボキサミド
  • (1R,2S,5R)-N-(4-methoxyphenyl)-5-methyl-2-(propan-2-yl)cyclohexane-1-carboxamide
Other name (2)：
  • (1R,2S,5R)-2-Isopropyl-N-(4-methoxyphenyl)-5-methylcyclohexanecarboxamide
  • WS-12
CAS registry number： 68489-09-8
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