Chem
J-GLOBAL ID:201207058316926375
Nikkaji number:J3.031.178G
1,4-Dimethyl-7-isopropylazulene-3-yl(3,4-dihydroxyphenyl)methylium
1,4-ジメチル-7-イソプロピルアズレン-3-イル(3,4-ジヒドロキシフェニル)メチリウム
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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:
C21 [C+]H23 O2
Molecular formula furigana:
C22-H23-O2
Molecular weight:
319.423
InChI:
InChI=1S/C22H22O2/c1-13(2)17-7-5-14(3)22-18(9-15(4)19(22)12-17)10-16-6-8-20(23)21(24)11-16/h5-13H,1-4H3,(H-,23,24)/p+1
InChI key:
HBHYBJYPKGQLHZ-UHFFFAOYSA-O
SMILES:
CC(C)c1ccc(C)c2c([CH+]c3ccc(O)c(O)c3)cc(C)c2c1
Systematic name (3):
1,4-ジメチル-7-イソプロピルアズレン-3-イル(3,4-ジヒドロキシフェニル)メチリウム
(3,4-ジヒドロキシフェニル)[3,8-ジメチル-5-(プロパン-2-イル)アズレン-1-イル]メチリウム
(3,4-dihydroxyphenyl)[3,8-dimethyl-5-(propan-2-yl)azulen-1-yl]methylium
Other name (1):
1,4-Dimethyl-7-isopropylazulene-3-yl(3,4-dihydroxyphenyl)methylium
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