Chem
J-GLOBAL ID:200907005115002629
Nikkaji number:J1.172.677A
1-Piperidino-3-(5-chloro-1H-benzimidazol-2-yl)-2-methyl-2-buten-1-one
1-ピペリジノ-3-(5-クロロ-1H-ベンゾイミダゾール-2-イル)-2-メチル-2-ブテン-1-オン
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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 H20 ClN3 O
Molecular formula furigana:
C17-H20-CL-N3-O
Molecular weight:
317.820
InChI:
InChI=1S/C17H20ClN3O/c1-11(12(2)17(22)21-8-4-3-5-9-21)16-19-14-7-6-13(18)10-15(14)20-16/h6-7,10H,3-5,8-9H2,1-2H3,(H,19,20)
InChI key:
JGDDCAKJPJAGBT-UHFFFAOYSA-N
SMILES:
CC(=C(C)c1nc2cc(Cl)ccc2[nH]1)C(=O)N1CCCCC1
Systematic name (3):
1-ピペリジノ-3-(5-クロロ-1H-ベンゾイミダゾール-2-イル)-2-メチル-2-ブテン-1-オン
3-(5-クロロ-1H-1,3-ベンゾジアゾール-2-イル)-2-メチル-1-(ピペリジン-1-イル)ブタ-2-エン-1-オン
3-(5-chloro-1H-1,3-benzodiazol-2-yl)-2-methyl-1-(piperidin-1-yl)but-2-en-1-one
Other name (1):
1-Piperidino-3-(5-chloro-1H-benzimidazol-2-yl)-2-methyl-2-buten-1-one
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