Chem
J-GLOBAL ID：200907060650602350   Nikkaji number：J461.334A

2-Methyl-4-morpholino-6-(m-chlorophenyl)-1,3-cyclohexadiene-1,5-dicarboxylic acid dimethyl ester

2-メチル-4-モルホリノ-6-(m-クロロフェニル)-1,3-シクロヘキサジエン-1,5-ジカルボン酸ジメチル
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： C21H24ClNO5
Molecular formula furigana： C21-H24-CL-N-O5
Molecular weight： 405.880
InChI： InChI=1S/C21H24ClNO5/c1-13-11-16(23-7-9-28-10-8-23)19(21(25)27-3)18(17(13)20(24)26-2)14-5-4-6-15(22)12-14/h4-6,11-12,18-19H,7-10H2,1-3H3
InChI key： YLNDHADOLLBSOQ-UHFFFAOYSA-N
SMILES： COC(=O)C1C(C(=C(C)C=C1N1CCOCC1)C(=O)OC)c1cccc(Cl)c1
Systematic name  (3)：
  • 2-メチル-4-モルホリノ-6-(m-クロロフェニル)-1,3-シクロヘキサジエン-1,5-ジカルボン酸ジメチル
  • 1,3-ジメチル 2-(3-クロロフェニル)-4-メチル-6-(モルホリン-4-イル)シクロヘキサ-3,5-ジエン-1,3-ジカルボキシラート
  • 1,3-dimethyl 2-(3-chlorophenyl)-4-methyl-6-(morpholin-4-yl)cyclohexa-3,5-diene-1,3-dicarboxylate
Other name (1)：
  • 2-Methyl-4-morpholino-6-(m-chlorophenyl)-1,3-cyclohexadiene-1,5-dicarboxylic acid dimethyl ester
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