Chem
J-GLOBAL ID:201507022604243506
Nikkaji number:J3.352.764K
1-[1-Oxo-3-piperidino(1-13 C-3,3-2 H2 )propyl]-4-butoxybenzene
1-[1-オキソ-3-ピペリジノ(1-13 C-3,3-2 H2 )プロピル]-4-ブトキシベンゼン
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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:
C17 [13 C]H25 [2 H]2 NO2
Molecular formula furigana:
C18-H27-N-O2
Molecular weight:
292.424
InChI:
InChI=1S/C18H27NO2/c1-2-3-15-21-17-9-7-16(8-10-17)18(20)11-14-19-12-5-4-6-13-19/h7-10H,2-6,11-15H2,1H3/i14D2,18+1
InChI key:
BZEWSEKUUPWQDQ-UAXBNMQJSA-N
SMILES:
C([2H])([2H])(C[13C](=O)c1ccc(OCCCC)cc1)N1CCCCC1
Systematic name (3):
1-[1-オキソ-3-ピペリジノ(1-13 C-3,3-2 H2 )プロピル]-4-ブトキシベンゼン
1-(4-ブトキシフェニル)-3-(ピペリジン-1-イル)(1-13 C,3,3-2 H2 )プロパン-1-オン
1-(4-butoxyphenyl)-3-(piperidin-1-yl)(1-13 C,3,3-2 H2 )propan-1-one
Other name (1):
1-[1-Oxo-3-piperidino(1-13 C-3,3-2 H2 )propyl]-4-butoxybenzene
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