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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > monocarboxylic acid amide > amidobenzoic acid > ni15501a
organooxygen compound > carboxamide > monocarboxylic acid amide > amidobenzoic acid > ni15501a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > monocarboxylic acid amide > amidobenzoic acid > ni15501a
... > organooxygen compound > carbonyl compound > carboxylic acid > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > ni15501a
... > organooxygen compound > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > ni15501a
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > ni15501a
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > ni15501a
organic aromatic compound > aromatic carboxylic acid > benzoic acids > amidobenzoic acid > ni15501a

Preferred term

ni15501a  

Type

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

Broader concept

charge

  • 0

formula

  • C12H15N3O3

inchi

  • InChI=1S/C12H15N3O3/c1-7(14-8(2)16)12(18)15-10-6-4-3-5-9(10)11(13)17/h3-7H,1-2H3,(H2,13,17)(H,14,16)(H,15,18)/t7-/m0/s1

inchikey

  • TVWVXIWYFXAZHZ-ZETCQYMHSA-N

mass

  • 249.270

monoisotopicmass

  • 249.11134

smiles

  • O=C(N)C1=C(NC(=O)[C@@H](NC(=O)C)C)C=CC=C1

subset

  • 2_STAR

synonym EXACT

  • 2-[[(2S)-2-acetamidopropanoyl]amino]benzamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223699

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