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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > nitro compound > c-nitro compound > 4-(3,5-dimethyl-4-nitro-1-pyrazolyl)butanoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > c-nitro compound > 4-(3,5-dimethyl-4-nitro-1-pyrazolyl)butanoic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > 4-(3,5-dimethyl-4-nitro-1-pyrazolyl)butanoic acid

Preferred term

4-(3,5-dimethyl-4-nitro-1-pyrazolyl)butanoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C9H13N3O4

inchi

  • InChI=1S/C9H13N3O4/c1-6-9(12(15)16)7(2)11(10-6)5-3-4-8(13)14/h3-5H2,1-2H3,(H,13,14)

inchikey

  • OKRDHPPYUAMLIR-UHFFFAOYSA-N

mass

  • 227.218

monoisotopicmass

  • 227.09061

smiles

  • CC1=C(C(=NN1CCCC(=O)O)C)[N+](=O)[O-]

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:94002

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