skip to main content

Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > acetamides > c-9154
organooxygen compound > carboxamide > acetamides > c-9154
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > acetamides > c-9154

Preferred term

c-9154  

Type

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

Broader concept

charge

  • 0

formula

  • C12H12N2O3

inchi

  • InChI=1S/C12H12N2O3/c13-10(15)6-7-11(16)14-12(17)8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,13,15)(H,14,16,17)/b7-6+

inchikey

  • RPPKWABVORYKHA-VOTSOKGWSA-N

mass

  • 232.239

monoisotopicmass

  • 232.08479

smiles

  • O=C(NC(=O)CC1=CC=CC=C1)/C=C/C(=O)N

subset

  • 2_STAR

synonym EXACT

  • (E)-N'-(2-phenylacetyl)but-2-enediamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:222534

Download this concept:

RDF/XML TURTLE JSON-LD