Chem
J-GLOBAL ID：200907017506416230
Nikkaji number：J1.448.516C
8H-Cyclohepta[d]oxepin-8-one
8H-3-オキサヘプタレン-8-オン
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
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
Molecular formula： C11H8O2
Molecular formula furigana： C11-H8-O2
Molecular weight： 172.183
InChI：
InChI=1S/C11H8O2/c12-11-3-1-9-5-7-13-8-6-10(9)2-4-11/h1-8H
InChI key：
OXQOILUGLAYVTH-UHFFFAOYSA-N
SMILES：
O=c1ccc2C=COC=Cc2cc1
Systematic name (3)：
- 8H-シクロヘプタ[d]オキセピン-8-オン
- 8H-3-オキサヘプタレン-8-オン
- 8H-3-oxaheptalen-8-one
- 8H-Cyclohepta[d]oxepin-8-one
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