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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > n-[2-(1h-benzimidazol-2-yl)ethyl]-4-chloro-3-nitrobenzamide
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > halide > organohalogen compound > n-[2-(1h-benzimidazol-2-yl)ethyl]-4-chloro-3-nitrobenzamide

Preferred term

n-[2-(1h-benzimidazol-2-yl)ethyl]-4-chloro-3-nitrobenzamide  

Type

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

charge

  • 0

formula

  • C16H13ClN4O3

inchi

  • InChI=1S/C16H13ClN4O3/c17-11-6-5-10(9-14(11)21(23)24)16(22)18-8-7-15-19-12-3-1-2-4-13(12)20-15/h1-6,9H,7-8H2,(H,18,22)(H,19,20)

inchikey

  • GYWDNVCGQOXZBI-UHFFFAOYSA-N

mass

  • 344.753

monoisotopicmass

  • 344.06762

smiles

  • C1=CC=C2C(=C1)NC(=N2)CCNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:120746

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