Chem
J-GLOBAL ID：200907024826760725
Nikkaji number：J1.108.721C
(4R)-3-(4-Chlorophenyl)-4-propyl-5,6-dihydro-4H-1,2-oxazine-6-ol
(4R)-3-(4-クロロフェニル)-4-プロピル-5,6-ジヒドロ-4H-1,2-オキサジン-6-オール
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
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
Molecular formula： C13H16ClNO2
Molecular formula furigana： C13-H16-CL-N-O2
Molecular weight： 253.730
InChI：
InChI=1S/C13H16ClNO2/c1-2-3-10-8-12(16)17-15-13(10)9-4-6-11(14)7-5-9/h4-7,10,12,16H,2-3,8H2,1H3/t10-,12?/m1/s1
InChI key：
TWHXYKHBABGMAP-RWANSRKNSA-N
SMILES：
CCC[C@@H]1CC(O)ON=C1c1ccc(Cl)cc1
Systematic name (2)：
- (4R)-3-(4-クロロフェニル)-4-プロピル-5,6-ジヒドロ-4H-1,2-オキサジン-6-オール
- (4R)-3-(4-chlorophenyl)-4-propyl-5,6-dihydro-4H-1,2-oxazin-6-ol
- (4R)-3-(4-Chlorophenyl)-4-propyl-5,6-dihydro-4H-1,2-oxazine-6-ol
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