Chem
J-GLOBAL ID:200907075251967830   Nikkaji number:J1.195.678E

3-(5-Amino-5-oxo-4,4-diphenylpentyl)-1-benzyl-2-methyl-3H-imidazol-1-ium

3-ベンジル-1-(4-カルバモイル-4,4-ジフェニルブチル)-2-メチル-1H-イミダゾール-3-イウム
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: C28H30N2[N+]O
Molecular formula furigana: C28-H30-N3-O
Molecular weight: 424.567
InChI: InChI=1S/C28H29N3O/c1-23-30(20-21-31(23)22-24-12-5-2-6-13-24)19-11-18-28(27(29)32,25-14-7-3-8-15-25)26-16-9-4-10-17-26/h2-10,12-17,20-21H,11,18-19,22H2,1H3,(H-,29,32)/p+1
InChI key: KFZQMMUSOMJBQB-UHFFFAOYSA-O
SMILES: Cc1n(CCCC(C(=O)N)(c2ccccc2)c2ccccc2)cc[n+]1Cc1ccccc1
Systematic name  (3):
  • 3-(5-アミノ-5-オキソ-4,4-ジフェニルペンチル)-1-ベンジル-2-メチル-3H-イミダゾール-1-イウム
  • 3-ベンジル-1-(4-カルバモイル-4,4-ジフェニルブチル)-2-メチル-1H-イミダゾール-3-イウム
  • 3-benzyl-1-(4-carbamoyl-4,4-diphenylbutyl)-2-methyl-1H-imidazol-3-ium
Other name (1):
  • 3-(5-Amino-5-oxo-4,4-diphenylpentyl)-1-benzyl-2-methyl-3H-imidazol-1-ium
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