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Chemistry, part 1

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Concept information

... > organic aromatic compound > aromatic amine > anilines > substituted aniline > nitroaniline > 4-[[4-(3-methylanilino)-3,5-dinitrophenyl]-oxomethyl]-1,3-dihydroquinoxalin-2-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > aromatic amine > anilines > substituted aniline > nitroaniline > 4-[[4-(3-methylanilino)-3,5-dinitrophenyl]-oxomethyl]-1,3-dihydroquinoxalin-2-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > aromatic amine > anilines > substituted aniline > nitroaniline > 4-[[4-(3-methylanilino)-3,5-dinitrophenyl]-oxomethyl]-1,3-dihydroquinoxalin-2-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > c-nitro compound > nitroaniline > 4-[[4-(3-methylanilino)-3,5-dinitrophenyl]-oxomethyl]-1,3-dihydroquinoxalin-2-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > nitroaniline > 4-[[4-(3-methylanilino)-3,5-dinitrophenyl]-oxomethyl]-1,3-dihydroquinoxalin-2-one

Preferred term

4-[[4-(3-methylanilino)-3,5-dinitrophenyl]-oxomethyl]-1,3-dihydroquinoxalin-2-one  

Type

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

Broader concept

charge

  • 0

formula

  • C22H17N5O6

inchi

  • InChI=1S/C22H17N5O6/c1-13-5-4-6-15(9-13)23-21-18(26(30)31)10-14(11-19(21)27(32)33)22(29)25-12-20(28)24-16-7-2-3-8-17(16)25/h2-11,23H,12H2,1H3,(H,24,28)

inchikey

  • TWYIZGPYZAVPMR-UHFFFAOYSA-N

mass

  • 447.401

monoisotopicmass

  • 447.11788

smiles

  • CC1=CC(=CC=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)N3CC(=O)NC4=CC=CC=C43)[N+](=O)[O-]

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:117235

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