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Concept information

Preferred term

2 [[(4 ترت بوتیل فنیل) اکسومتیل] آمینو] کلروبنزوئیک اسید  

Type

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

Broader concept

charge

  • 0

formula

  • C18H18ClNO3

inchi

  • InChI=1S/C18H18ClNO3/c1-18(2,3)12-6-4-11(5-7-12)16(21)20-15-10-13(19)8-9-14(15)17(22)23/h4-10H,1-3H3,(H,20,21)(H,22,23)

inchikey

  • MDPKOGIGDWVDDL-UHFFFAOYSA-N

mass

  • 331.794

monoisotopicmass

  • 331.09752

smiles

  • CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)C(=O)O

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:92049

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