Chem
J-GLOBAL ID:200907049001620800   Nikkaji number:J407.987F

2-[(3R)-3-Methyl-2-oxo-5-hexenyl]-1,3-dibenzyloctahydro-1H-1,3,2-benzodiazaphosphole 2-oxide

2-[(3R)-3-メチル-2-オキソ-5-ヘキセニル]-1,3-ジベンジルオクタヒドロ-1H-1,3,2-ベンゾジアザホスホール2-オキシド
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: C27H35N2O[O-][P+]
Molecular formula furigana: C27-H35-N2-O2-P
Molecular weight: 450.563
InChI: InChI=1S/C27H35N2O2P/c1-3-12-22(2)27(30)21-32(31)28(19-23-13-6-4-7-14-23)25-17-10-11-18-26(25)29(32)20-24-15-8-5-9-16-24/h3-9,13-16,22,25-26H,1,10-12,17-21H2,2H3/t22-,25?,26?,32?/m1/s1
InChI key: OWZXTDWONIGOIK-GZCGUHROSA-N
SMILES: C[C@H](CC=C)C(=O)C[P+]1([O-])N(Cc2ccccc2)C2CCCCC2N1Cc1ccccc1
Systematic name  (3):
  • 2-[(3R)-3-メチル-2-オキソ-5-ヘキセニル]-1,3-ジベンジルオクタヒドロ-1H-1,3,2-ベンゾジアザホスホール2-オキシド
  • 1,3-ジベンジル-2-[(3R)-3-メチル-2-オキソヘキサ-5-エン-1-イル]-オクタヒドロ-1H-1,3,2-ベンゾジアザホスホール-2-イウム-2-オラート
  • 1,3-dibenzyl-2-[(3R)-3-methyl-2-oxohex-5-en-1-yl]-octahydro-1H-1,3,2-benzodiazaphosphol-2-ium-2-olate
Other name (1):
  • 2-[(3R)-3-Methyl-2-oxo-5-hexenyl]-1,3-dibenzyloctahydro-1H-1,3,2-benzodiazaphosphole 2-oxide
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