Chem
J-GLOBAL ID:200907096228206900   Nikkaji number:J1.590.894G

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

(3S)-N-(4-メチルフェニル)-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: C15H23NO3
Molecular formula furigana: C15-H23-N-O3
Molecular weight: 265.353
InChI: InChI=1S/C15H23NO3/c1-10(2)13-17-14(15(4,5)19-18-13)16-12-8-6-11(3)7-9-12/h6-10,13-14,16H,1-5H3/t13-,14+/m0/s1
InChI key: BATHJLSIDDJORA-UONOGXRCSA-N
SMILES: CC(C)[C@@H]1OOC(C)(C)[C@H](Nc2ccc(C)cc2)O1
Systematic name  (3):
  • (3S)-N-(4-メチルフェニル)-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)-6,6-ジメチル-N-(4-メチルフェニル)-3-(プロパン-2-イル)-1,2,4-トリオキサン-5-アミン
  • (3S,5R)-6,6-dimethyl-N-(4-methylphenyl)-3-(propan-2-yl)-1,2,4-trioxan-5-amine
Other name (1):
  • (3S)-N-(4-Methylphenyl)-3β-isopropyl-6,6-dimethyl-1,2,4-trioxane-5β-amine
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