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Chemistry, part 2

Content language

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Concept information

organooxygen compound > carbonyl compound > ketone > aromatic ketone > 3-(4-oxo-1h-quinazolin-2-yl)propanoic acid [1-(4-bromophenyl)-1-oxopropan-2-yl] ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 3-(4-oxo-1h-quinazolin-2-yl)propanoic acid [1-(4-bromophenyl)-1-oxopropan-2-yl] ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 3-(4-oxo-1h-quinazolin-2-yl)propanoic acid [1-(4-bromophenyl)-1-oxopropan-2-yl] ester

Preferred term

3-(4-oxo-1h-quinazolin-2-yl)propanoic acid [1-(4-bromophenyl)-1-oxopropan-2-yl] ester  

Type

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

Broader concept

charge

  • 0

formula

  • C20H17BrN2O4

inchi

  • InChI=1S/C20H17BrN2O4/c1-12(19(25)13-6-8-14(21)9-7-13)27-18(24)11-10-17-22-16-5-3-2-4-15(16)20(26)23-17/h2-9,12H,10-11H2,1H3,(H,22,23,26)

inchikey

  • VWRPHYLRDNHSJG-UHFFFAOYSA-N

mass

  • 429.264

monoisotopicmass

  • 428.03717

smiles

  • CC(C(=O)C1=CC=C(C=C1)Br)OC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:109093

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