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Chemistry, part 1

Content language

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Concept information

organic aromatic compound > quinolines > iwr-1-endo
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > quinolines > iwr-1-endo
organic heterocyclic compound > organonitrogen heterocyclic compound > quinolines > iwr-1-endo
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > secondary amide > imide > dicarboximide > iwr-1-endo
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > monocarboxylic acid amide > arenecarboxamide > benzamides > iwr-1-endo
... > organooxygen compound > carboxamide > monocarboxylic acid amide > arenecarboxamide > benzamides > iwr-1-endo
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > monocarboxylic acid amide > arenecarboxamide > benzamides > iwr-1-endo

Preferred term

iwr-1-endo  

Type

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

Broader concept

charge

  • 0

formula

  • C25H19N3O3

has_role

inchi

  • InChI=1S/C25H19N3O3/c29-23(27-19-5-1-3-14-4-2-12-26-22(14)19)15-8-10-18(11-9-15)28-24(30)20-16-6-7-17(13-16)21(20)25(28)31/h1-12,16-17,20-21H,13H2,(H,27,29)/t16-,17+,20-,21+

inchikey

  • ZGSXEXBYLJIOGF-ALFLXDJESA-N

mass

  • 409.438

monoisotopicmass

  • 409.14264

smiles

  • [C@@]12([C@H]3C=C[C@@H]([C@]1(C(N(C2=O)C=4C=CC(=CC4)C(NC=5C6=C(C=CC5)C=CC=N6)=O)=O)[H])C3)[H]

subset

  • 3_STAR

synonym EXACT

  • 4-[(3aR,4S,7R,7aS)-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]-N-(quinolin-8-yl)benzamide

synonym RELATED

  • IRW1

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:62882

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