Chem
J-GLOBAL ID:200907047373293578
Nikkaji number:J1.590.892K
(3S)-N-(3-Methylphenyl)-3β-isopropyl-6,6-dimethyl-1,2,4-trioxane-5β-amine
(3S)-N-(3-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
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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:
C15 H23 NO3
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)16-12-8-6-7-11(3)9-12/h6-10,13-14,16H,1-5H3/t13-,14+/m0/s1
InChI key:
HEFJUCNRQNEEIJ-UONOGXRCSA-N
SMILES:
CC(C)[C@@H]1OOC(C)(C)[C@H](Nc2cccc(C)c2)O1
Systematic name (3):
(3S)-N-(3-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-(3-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-(3-methylphenyl)-3-(propan-2-yl)-1,2,4-trioxan-5-amine
Other name (1):
(3S)-N-(3-Methylphenyl)-3β-isopropyl-6,6-dimethyl-1,2,4-trioxane-5β-amine
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