Chem
J-GLOBAL ID:200907077049773792
Nikkaji number:J758.969G
3-(4-Ethyl-3-nitrophenyl)-3-(4-hydroxyphenyl)isobenzofuran-1(3H)-one
3-(4-エチル-3-ニトロフェニル)-3-(4-ヒドロキシフェニル)イソベンゾフラン-1(3H)-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 [N+]O4 [O-]
Molecular formula furigana:
C22-H17-N-O5
Molecular weight:
375.380
InChI:
InChI=1S/C22H17NO5/c1-2-14-7-8-16(13-20(14)23(26)27)22(15-9-11-17(24)12-10-15)19-6-4-3-5-18(19)21(25)28-22/h3-13,24H,2H2,1H3
InChI key:
MYOMHFYDEHBNOL-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1[N+](=O)[O-])C1(OC(=O)c2ccccc12)c1ccc(O)cc1
Systematic name (3):
3-(4-エチル-3-ニトロフェニル)-3-(4-ヒドロキシフェニル)イソベンゾフラン-1(3H)-オン
3-(4-エチル-3-ニトロフェニル)-3-(4-ヒドロキシフェニル)-1,3-ジヒドロ-2-ベンゾフラン-1-オン
3-(4-ethyl-3-nitrophenyl)-3-(4-hydroxyphenyl)-1,3-dihydro-2-benzofuran-1-one
Other name (1):
3-(4-Ethyl-3-nitrophenyl)-3-(4-hydroxyphenyl)isobenzofuran-1(3H)-one
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