Chem
J-GLOBAL ID:201507088016485286
Nikkaji number:J3.374.660A
1-(3-Oxobutyl)-2-oxocycloheptane-1-carboxylic acid 2-(1-ethylpropoxy)phenyl ester
1-(3-オキソブチル)-2-オキソシクロヘプタン-1-カルボン酸2-(1-エチルプロポキシ)フェニル
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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:
C23 H32 O5
Molecular formula furigana:
C23-H32-O5
Molecular weight:
388.504
InChI:
InChI=1S/C23H32O5/c1-4-18(5-2)27-19-11-8-9-12-20(19)28-22(26)23(16-14-17(3)24)15-10-6-7-13-21(23)25/h8-9,11-12,18H,4-7,10,13-16H2,1-3H3
InChI key:
QYLDOGGBOACTLF-UHFFFAOYSA-N
SMILES:
CCC(CC)Oc1ccccc1OC(=O)C1(CCC(=O)C)CCCCCC1=O
Systematic name (3):
1-(3-オキソブチル)-2-オキソシクロヘプタン-1-カルボン酸2-(1-エチルプロポキシ)フェニル
2-(ペンタン-3-イルオキシ)フェニル 2-オキソ-1-(3-オキソブチル)シクロヘプタン-1-カルボキシラート
2-(pentan-3-yloxy)phenyl 2-oxo-1-(3-oxobutyl)cycloheptane-1-carboxylate
Other name (1):
1-(3-Oxobutyl)-2-oxocycloheptane-1-carboxylic acid 2-(1-ethylpropoxy)phenyl ester
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