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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > olefinic compound > enamide > cinnamamides > xct 790
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > alpha,beta-unsaturated carboxylic acid amide > enamide > cinnamamides > xct 790
... > organooxygen compound > carboxamide > alpha,beta-unsaturated carboxylic acid amide > enamide > cinnamamides > xct 790
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > alpha,beta-unsaturated carboxylic acid amide > enamide > cinnamamides > xct 790

Preferred term

xct 790  

Type

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

Broader concept

charge

  • 0

formula

  • C23H13F9N4O3S

inchi

  • InChI=1S/C23H13F9N4O3S/c1-38-17-7-11(6-13(9-33)18(37)34-20-36-35-19(40-20)23(30,31)32)2-5-16(17)39-10-12-3-4-14(21(24,25)26)8-15(12)22(27,28)29/h2-8H,10H2,1H3,(H,34,36,37)/b13-6+

inchikey

  • HQFNFOOGGLSBBT-AWNIVKPZSA-N

mass

  • 596.42500

monoisotopicmass

  • 596.05646

smiles

  • COc1cc(ccc1OCc1ccc(cc1C(F)(F)F)C(F)(F)F)/C=C(/C#N)C(=O)Nc1nnc(s1)C(F)(F)F

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79999

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