Chem
J-GLOBAL ID:200907024645253082   Nikkaji number:J1.829.951H

1-(2-Chlorophenyl)-3-[[(1R)-1,3,3-trimethyl-5β-hydroxycyclohexane-1α-yl]methyl]urea

1-(2-クロロフェニル)-3-{[(1R,5R)-5-ヒドロキシ-1,3,3-トリメチルシクロヘキシル]メチル}尿素
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: C17H25ClN2O2
Molecular formula furigana: C17-H25-CL-N2-O2
Molecular weight: 324.850
InChI: InChI=1S/C17H25ClN2O2/c1-16(2)8-12(21)9-17(3,10-16)11-19-15(22)20-14-7-5-4-6-13(14)18/h4-7,12,21H,8-11H2,1-3H3,(H2,19,20,22)/t12-,17+/m1/s1
InChI key: TWFKCEVMSCRJCU-PXAZEXFGSA-N
SMILES: CC1(C)C[C@@H](O)C[C@](C)(CNC(=O)Nc2ccccc2Cl)C1
Systematic name  (3):
  • 1-(2-クロロフェニル)-3-[[(1R)-1,3,3-トリメチル-5β-ヒドロキシシクロヘキサン-1α-イル]メチル]尿素
  • 1-(2-クロロフェニル)-3-{[(1R,5R)-5-ヒドロキシ-1,3,3-トリメチルシクロヘキシル]メチル}尿素
  • 1-(2-chlorophenyl)-3-{[(1R,5R)-5-hydroxy-1,3,3-trimethylcyclohexyl]methyl}urea
Other name (1):
  • 1-(2-Chlorophenyl)-3-[[(1R)-1,3,3-trimethyl-5β-hydroxycyclohexane-1α-yl]methyl]urea
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