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Concept information

Preferred term

(s)-3-[(cyanophenylmethyl)amino]-3-oxopropanoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C11H10N2O3

inchi

  • InChI=1S/C11H10N2O3/c12-7-9(8-4-2-1-3-5-8)13-10(14)6-11(15)16/h1-5,9H,6H2,(H,13,14)(H,15,16)

inchikey

  • WMOFHAQITVHGSC-UHFFFAOYSA-N

mass

  • 218.212

monoisotopicmass

  • 218.06914

smiles

  • O=C(NC(C1=CC=CC=C1)C#N)CC(O)=O

subset

  • 2_STAR

synonym EXACT

  • 3-[[cyano(phenyl)methyl]amino]-3-oxopropanoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:187807

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