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Concept information

Preferred term

3-hydroxy-2-[5-nitro-2-(1-pyrrolidinyl)benzyl]propanenitrile  

Type

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

Broader concept

charge

  • 0

formula

  • C14H17N3O3

inchi

  • InChI=1S/C14H17N3O3/c15-9-11(10-18)7-12-8-13(17(19)20)3-4-14(12)16-5-1-2-6-16/h3-4,8,11,18H,1-2,5-7,10H2

inchikey

  • SMBDGASUWGZVPP-UHFFFAOYSA-N

mass

  • 275.308

monoisotopicmass

  • 275.12699

smiles

  • OCC(CC1=C(N2CCCC2)C=CC([N+]([O-])=O)=C1)C#N

subset

  • 2_STAR

synonym EXACT

  • 2-(hydroxymethyl)-3-(5-nitro-2-pyrrolidin-1-ylphenyl)propanenitrile

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:192661

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