Chem
J-GLOBAL ID:200907005506481505   Nikkaji number:J1.590.895E

(3S)-N-(3-Methoxyphenyl)-3β-isopropyl-6,6-dimethyl-1,2,4-trioxane-5β-amine

(3S)-N-(3-メトキシフェニル)-3β-イソプロピル-6,6-ジメチル-1,2,4-トリオキサン-5β-アミン
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: C15H23NO4
Molecular formula furigana: C15-H23-N-O4
Molecular weight: 281.352
InChI: InChI=1S/C15H23NO4/c1-10(2)13-18-14(15(3,4)20-19-13)16-11-7-6-8-12(9-11)17-5/h6-10,13-14,16H,1-5H3/t13-,14+/m0/s1
InChI key: RGZFSKCGONRMQF-UONOGXRCSA-N
SMILES: COc1cccc(N[C@@H]2O[C@@H](OOC2(C)C)C(C)C)c1
Systematic name  (3):
  • (3S)-N-(3-メトキシフェニル)-3β-イソプロピル-6,6-ジメチル-1,2,4-トリオキサン-5β-アミン
  • (3S,5R)-N-(3-メトキシフェニル)-6,6-ジメチル-3-(プロパン-2-イル)-1,2,4-トリオキサン-5-アミン
  • (3S,5R)-N-(3-methoxyphenyl)-6,6-dimethyl-3-(propan-2-yl)-1,2,4-trioxan-5-amine
Other name (1):
  • (3S)-N-(3-Methoxyphenyl)-3β-isopropyl-6,6-dimethyl-1,2,4-trioxane-5β-amine
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