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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > ureas > 4-[butan-2-yl-[(3,4-dichloroanilino)-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester

Preferred term

4-[butan-2-yl-[(3,4-dichloroanilino)-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester  

Type

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

Broader concept

charge

  • 0

formula

  • C19H27Cl2N3O3

inchi

  • InChI=1S/C19H27Cl2N3O3/c1-4-13(3)24(15-8-10-23(11-9-15)19(26)27-5-2)18(25)22-14-6-7-16(20)17(21)12-14/h6-7,12-13,15H,4-5,8-11H2,1-3H3,(H,22,25)

inchikey

  • UMRGNIRTRURPLM-UHFFFAOYSA-N

mass

  • 416.343

monoisotopicmass

  • 415.14295

smiles

  • CCC(C)N(C1CCN(CC1)C(=O)OCC)C(=O)NC2=CC(=C(C=C2)Cl)Cl

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:109423

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