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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ether > aromatic ether > 4-(3,4-dihydro-2h-1,5-benzodioxepin-7-ylamino)-4-oxobutanoic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > aromatic ether > 4-(3,4-dihydro-2h-1,5-benzodioxepin-7-ylamino)-4-oxobutanoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > aromatic ether > 4-(3,4-dihydro-2h-1,5-benzodioxepin-7-ylamino)-4-oxobutanoic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > aromatic ether > 4-(3,4-dihydro-2h-1,5-benzodioxepin-7-ylamino)-4-oxobutanoic acid

Preferred term

4-(3,4-dihydro-2h-1,5-benzodioxepin-7-ylamino)-4-oxobutanoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C13H15NO5

inchi

  • InChI=1S/C13H15NO5/c15-12(4-5-13(16)17)14-9-2-3-10-11(8-9)19-7-1-6-18-10/h2-3,8H,1,4-7H2,(H,14,15)(H,16,17)

inchikey

  • KZUHIEYBYXSCJE-UHFFFAOYSA-N

mass

  • 265.265

monoisotopicmass

  • 265.09502

smiles

  • O1CCCOC2=C1C=C(NC(=O)CCC(O)=O)C=C2

subset

  • 2_STAR

synonym EXACT

  • 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-4-oxobutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:192630

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