Chem
J-GLOBAL ID:200907025406320904   Nikkaji number:J2.458.623E

(3R,5S,9aα)-3β-(Allyloxymethyl)-6α-(4-bromophenyl)-7β-methyloctahydropyrido[2,1-c][1,4]oxazine-1-one

(3R,5S,9aα)-3β-(アリルオキシメチル)-6α-(4-ブロモフェニル)-7β-メチルオクタヒドロピリド[2,1-c][1,4]オキサジン-1-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: C19H24BrNO3
Molecular formula furigana: C19-H24-BR-N-O3
Molecular weight: 394.309
InChI: InChI=1S/C19H24BrNO3/c1-3-10-23-12-16-11-21-17(19(22)24-16)9-4-13(2)18(21)14-5-7-15(20)8-6-14/h3,5-8,13,16-18H,1,4,9-12H2,2H3/t13-,16+,17-,18-/m0/s1
InChI key: KXNPKRXETJPXBU-NBMRYCAZSA-N
SMILES: C[C@H]1CC[C@@H]2N(C[C@H](COCC=C)OC2=O)[C@@H]1c1ccc(Br)cc1
Systematic name  (3):
  • (3R,5S,9aα)-3β-(アリルオキシメチル)-6α-(4-ブロモフェニル)-7β-メチルオクタヒドロピリド[2,1-c][1,4]オキサジン-1-オン
  • (3R,6S,7S,9aS)-6-(4-ブロモフェニル)-7-メチル-3-[(プロパ-2-エン-1-イルオキシ)メチル]-オクタヒドロピリド[2,1-c][1,4]オキサジン-1-オン
  • (3R,6S,7S,9aS)-6-(4-bromophenyl)-7-methyl-3-[(prop-2-en-1-yloxy)methyl]-octahydropyrido[2,1-c][1,4]oxazin-1-one
Other name (1):
  • (3R,5S,9aα)-3β-(Allyloxymethyl)-6α-(4-bromophenyl)-7β-methyloctahydropyrido[2,1-c][1,4]oxazine-1-one
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