Chem
J-GLOBAL ID：200907001449351050   Nikkaji number：J2.426.548J

[3,8-Dimethyl-5-isopropylazulene-1-yl][2-[(2H)carboxy]phenyl]methanium

[3,8-ジメチル-5-イソプロピルアズレン-1-イル][2-[(2H)カルボキシ]フェニル]メタニウム
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： C22[C+]H24[2H]O2
Molecular formula furigana： C23-H25-O2
Molecular weight： 334.457
InChI： InChI=1S/C23H22O2/c1-14(2)17-10-9-15(3)22-19(11-16(4)21(22)13-17)12-18-7-5-6-8-20(18)23(24)25/h5-11,13-14H,1-4H3,(H,24,25)/q+1/i/hD
InChI key： AOUUWQZDNLXWSA-DYCDLGHISA-N
SMILES： O([2H])C(=O)c1ccccc1[C+]c1cc(C)c2cc(ccc(C)c12)C(C)C
Systematic name  (3)：
  • [3,8-ジメチル-5-イソプロピルアズレン-1-イル][2-[(2H)カルボキシ]フェニル]メタニウム
  • {2-[(2H)カルボキシ]フェニル}[3,8-ジメチル-5-(プロパン-2-イル)アズレン-1-イル]メタニウム
  • {2-[(2H)carboxy]phenyl}[3,8-dimethyl-5-(propan-2-yl)azulen-1-yl]methanium
Other name (1)：
  • [3,8-Dimethyl-5-isopropylazulene-1-yl][2-[(2H)carboxy]phenyl]methanium
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