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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > 3-chloro-n-methyl-n-[4-(1-pyrrolidinyl)but-2-ynyl]benzamide
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > halide > organohalogen compound > 3-chloro-n-methyl-n-[4-(1-pyrrolidinyl)but-2-ynyl]benzamide

Preferred term

3-chloro-n-methyl-n-[4-(1-pyrrolidinyl)but-2-ynyl]benzamide  

Type

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

charge

  • 0

formula

  • C16H19ClN2O

inchi

  • InChI=1S/C16H19ClN2O/c1-18(9-2-3-10-19-11-4-5-12-19)16(20)14-7-6-8-15(17)13-14/h6-8,13H,4-5,9-12H2,1H3

inchikey

  • LYFUGTMFJXJBCO-UHFFFAOYSA-N

mass

  • 290.788

monoisotopicmass

  • 290.11859

smiles

  • CN(CC#CCN1CCCC1)C(=O)C2=CC(=CC=C2)Cl

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:93061

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