Chem
J-GLOBAL ID:200907002900169135
Nikkaji number:J766.177K
1-(5-Methyl-2-thienyl)-7-[4-[(4,5-dihydrooxazol)-2-yl]-2-chlorophenoxy]heptan-1-one
1-(5-メチル-2-チエニル)-7-[4-[(4,5-ジヒドロオキサゾール)-2-イル]-2-クロロフェノキシ]ヘプタン-1-オン
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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 H24 ClNO3 S
Molecular formula furigana:
C21-H24-CL-N-O3-S
Molecular weight:
405.940
InChI:
InChI=1S/C21H24ClNO3S/c1-15-7-10-20(27-15)18(24)6-4-2-3-5-12-25-19-9-8-16(14-17(19)22)21-23-11-13-26-21/h7-10,14H,2-6,11-13H2,1H3
InChI key:
MFLRLCSOADAHET-UHFFFAOYSA-N
SMILES:
Cc1ccc(s1)C(=O)CCCCCCOc1ccc(cc1Cl)C1=NCCO1
Systematic name (3):
1-(5-メチル-2-チエニル)-7-[4-[(4,5-ジヒドロオキサゾール)-2-イル]-2-クロロフェノキシ]ヘプタン-1-オン
7-[2-クロロ-4-(4,5-ジヒドロ-1,3-オキサゾール-2-イル)フェノキシ]-1-(5-メチルチオフェン-2-イル)ヘプタン-1-オン
7-[2-chloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]-1-(5-methylthiophen-2-yl)heptan-1-one
Other name (1):
1-(5-Methyl-2-thienyl)-7-[4-[(4,5-dihydrooxazol)-2-yl]-2-chlorophenoxy]heptan-1-one
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