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Concept information

Preferred term

(2R,3R,4S) 1 (2 فلوروبنزوئیل) 4 (هیدروکسی متیل) 3 فنیلازتیدین 2 کربونیتریل  

Type

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

charge

  • 0

formula

  • C18H15FN2O2

inchi

  • InChI=1S/C18H15FN2O2/c19-14-9-5-4-8-13(14)18(23)21-15(10-20)17(16(21)11-22)12-6-2-1-3-7-12/h1-9,15-17,22H,11H2/t15-,16+,17+/m0/s1

inchikey

  • BPKNALSRVQDTLI-GVDBMIGSSA-N

mass

  • 310.323

monoisotopicmass

  • 310.11176

smiles

  • C1=CC=C(C=C1)[C@H]2[C@H](N([C@H]2C#N)C(=O)C3=CC=CC=C3F)CO

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:97226

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