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Concept information

... > organooxygen compound > ether > aromatic ether > methoxybenzenes > dimethoxybenzene > 2-(4-bromophenyl)-n-[(2-chloro-3,4-dimethoxyphenyl)methyl]-1-cyclopropanamine
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > aromatic ether > methoxybenzenes > dimethoxybenzene > 2-(4-bromophenyl)-n-[(2-chloro-3,4-dimethoxyphenyl)methyl]-1-cyclopropanamine
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > aromatic ether > methoxybenzenes > dimethoxybenzene > 2-(4-bromophenyl)-n-[(2-chloro-3,4-dimethoxyphenyl)methyl]-1-cyclopropanamine

Preferred term

2-(4-bromophenyl)-n-[(2-chloro-3,4-dimethoxyphenyl)methyl]-1-cyclopropanamine  

Type

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

Broader concept

charge

  • 0

formula

  • C18H19BrClNO2

inchi

  • InChI=1S/C18H19BrClNO2/c1-22-16-8-5-12(17(20)18(16)23-2)10-21-15-9-14(15)11-3-6-13(19)7-4-11/h3-8,14-15,21H,9-10H2,1-2H3

inchikey

  • LJSCHEYZTSVWCB-UHFFFAOYSA-N

mass

  • 396.706

monoisotopicmass

  • 395.02877

smiles

  • COC1=C(C(=C(C=C1)CNC2CC2C3=CC=C(C=C3)Br)Cl)OC

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:125410

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