Chem
J-GLOBAL ID:200907045421245049
Nikkaji number:J724.474F
Octanoic acid 4-[2-oxo-7-(diethylamino)-3-chromen-3-yl]benzyl ester
オクタン酸4-[2-オキソ-7-(ジエチルアミノ)-3-クロメン-3-イル]ベンジル
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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:
C28 H35 NO4
Molecular formula furigana:
C28-H35-N-O4
Molecular weight:
449.591
InChI:
InChI=1S/C28H35NO4/c1-4-7-8-9-10-11-27(30)32-20-21-12-14-22(15-13-21)25-18-23-16-17-24(29(5-2)6-3)19-26(23)33-28(25)31/h12-19H,4-11,20H2,1-3H3
InChI key:
MOVHSEIFBFWCEA-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)OCc1ccc(cc1)c1cc2ccc(cc2oc1=O)N(CC)CC
Systematic name (3):
オクタン酸4-[2-オキソ-7-(ジエチルアミノ)-3-クロメン-3-イル]ベンジル
{4-[7-(ジエチルアミノ)-2-オキソ-2H-クロメン-3-イル]フェニル}メチル オクタノアート
{4-[7-(diethylamino)-2-oxo-2H-chromen-3-yl]phenyl}methyl octanoate
Other name (1):
Octanoic acid 4-[2-oxo-7-(diethylamino)-3-chromen-3-yl]benzyl ester
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