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Concept information

... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > chromenes > 2,2,4-trimethyl-3-(4-methoxyphenyl)-2h-1-benzopyran-7-ol acetate
organooxygen compound > ester > carboxylic ester > acetate ester > 2,2,4-trimethyl-3-(4-methoxyphenyl)-2h-1-benzopyran-7-ol acetate
organooxygen compound > carbonyl compound > carboxylic ester > acetate ester > 2,2,4-trimethyl-3-(4-methoxyphenyl)-2h-1-benzopyran-7-ol acetate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > acetate ester > 2,2,4-trimethyl-3-(4-methoxyphenyl)-2h-1-benzopyran-7-ol acetate
... > organooxygen compound > ether > aromatic ether > methoxybenzenes > monomethoxybenzene > 2,2,4-trimethyl-3-(4-methoxyphenyl)-2h-1-benzopyran-7-ol acetate

Preferred term

2,2,4-trimethyl-3-(4-methoxyphenyl)-2h-1-benzopyran-7-ol acetate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C21H22O4

inchi

  • InChI=1S/C21H22O4/c1-13-18-11-10-17(24-14(2)22)12-19(18)25-21(3,4)20(13)15-6-8-16(23-5)9-7-15/h6-12H,1-5H3

inchikey

  • FBKRESBGJGGEEA-UHFFFAOYSA-N

mass

  • 338.39700

monoisotopicmass

  • 338.15181

smiles

  • COc1ccc(cc1)C1=C(C)c2ccc(OC(C)=O)cc2OC1(C)C

subset

  • 3_STAR

synonym EXACT

  • 3-(4-methoxyphenyl)-2,2,4-trimethyl-2H-1-benzopyran-7-yl acetate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79579

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