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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 > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > benzopyrrole > indoles > indolyl carboxylic acid > sb 228357
... > organic heterocyclic compound > organonitrogen heterocyclic compound > benzopyrrole > indoles > indolyl carboxylic acid > sb 228357
... > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzopyrrole > indoles > indolyl carboxylic acid > sb 228357
organooxygen compound > carbonyl compound > carboxylic acid > indolyl carboxylic acid > sb 228357
organooxygen compound > carbon oxoacid > carboxylic acid > indolyl carboxylic acid > sb 228357
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > indolyl carboxylic acid > sb 228357
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > indolyl carboxylic acid > sb 228357

Preferred term

sb 228357  

Type

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

Broader concept

charge

  • 0

formula

  • C22H17F4N3O2

inchi

  • InChI=1S/C22H17F4N3O2/c1-31-20-9-13-4-6-29(19(13)11-18(20)22(24,25)26)21(30)28-17-8-15(7-16(23)10-17)14-3-2-5-27-12-14/h2-3,5,7-12H,4,6H2,1H3,(H,28,30)

inchikey

  • RRJLJKRFFRZRAF-UHFFFAOYSA-N

mass

  • 431.384

monoisotopicmass

  • 431.12569

smiles

  • COc1cc2CCN(C(=O)Nc3cc(F)cc(c3)-c3cccnc3)c2cc1C(F)(F)F

subset

  • 2_STAR

synonym EXACT

  • SB 228357

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:8979

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