Chem
J-GLOBAL ID:201507009566707580
Nikkaji number:J3.343.090F
Fenquinotrione
フェンキノトリオン
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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:
C22 H17 ClN2 O5
Molecular formula furigana:
C22-H17-CL-N2-O5
Molecular weight:
424.840
InChI:
InChI=1S/C22H17ClN2O5/c1-30-13-10-8-12(9-11-13)25-15-5-2-4-14(23)19(15)24-20(22(25)29)21(28)18-16(26)6-3-7-17(18)27/h2,4-5,8-11,18H,3,6-7H2,1H3
InChI key:
KPSTXQYTZBZXMM-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)n1c2cccc(Cl)c2nc(C(=O)C2C(=O)CCCC2=O)c1=O
Systematic name (3):
1-(4-メトキシフェニル)-3-(2,6-ジオキソシクロヘキサン-1-イルカルボニル)-5-クロロキノキサリン-2(1H)-オン
2-[8-クロロ-4-(4-メトキシフェニル)-3-オキソ-3,4-ジヒドロキノキサリン-2-カルボニル]シクロヘキサン-1,3-ジオン
2-[8-chloro-4-(4-methoxyphenyl)-3-oxo-3,4-dihydroquinoxaline-2-carbonyl]cyclohexane-1,3-dione
Other name (4):
1-(4-Methoxyphenyl)-3-(2,6-dioxocyclohexane-1-ylcarbonyl)-5-chloroquinoxaline-2(1H)-one
フェンキノトリオン
Fenquinotrione
KIH-3653
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