Chem
J-GLOBAL ID:201107050134127584   Nikkaji number:J2.911.918J

(4S,4aα,8aα)-4α-(4-Methylphenyl)octahydro-7H-pyrano[2,3-d]pyrimidine-2-one

(4S,4aα,8aα)-4α-(4-メチルフェニル)オクタヒドロ-7H-ピラノ[2,3-d]ピリミジン-2-オン
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: C14H18N2O2
Molecular formula furigana: C14-H18-N2-O2
Molecular weight: 246.310
InChI: InChI=1S/C14H18N2O2/c1-9-4-6-10(7-5-9)12-11-3-2-8-18-13(11)16-14(17)15-12/h4-7,11-13H,2-3,8H2,1H3,(H2,15,16,17)/t11-,12-,13-/m1/s1
InChI key: QOYHHHKASFWJIT-JHJVBQTASA-N
SMILES: Cc1ccc(cc1)[C@H]1NC(=O)N[C@@H]2OCCC[C@H]12
Systematic name  (3):
  • (4S,4aα,8aα)-4α-(4-メチルフェニル)オクタヒドロ-7H-ピラノ[2,3-d]ピリミジン-2-オン
  • (4S,4aR,8aR)-4-(4-メチルフェニル)-オクタヒドロ-1H-ピラノ[2,3-d]ピリミジン-2-オン
  • (4S,4aR,8aR)-4-(4-methylphenyl)-octahydro-1H-pyrano[2,3-d]pyrimidin-2-one
Other name (1):
  • (4S,4aα,8aα)-4α-(4-Methylphenyl)octahydro-7H-pyrano[2,3-d]pyrimidine-2-one
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