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Home> Hot Product Listed N   > n-[(4-fluorophenyl)(oxolan-2-yl)methyl]-2-methanesulfonamidoacetamide
58315-37-0 structure

n-[(4-fluorophenyl)(oxolan-2-yl)methyl]-2-methanesulfonamidoacetamide

Iupac Name:1-(2-methoxy-5-nitrophenyl)piperazine
CAS No.:58315-37-0
Molecular Weight:237.259
Molecular Formula:C18H18N6O2 (isomer)
Names and Identifiers
Synonyms

MCULE-2765210317 MOLPORT-028-948-337 Z828370490

Inchi
InChI=1S/C11H15N3O3/c1-17-11-3-2-9(14(15)16)8-10(11)13-6-4-12-5-7-13/h2-3,8,12H,4-7H2,1H3
InChkey
HGXYVYNKYQZXMX-UHFFFAOYSA-N
Canonical Smiles
COC1=C(C=C(C=C1)[N+](=O)[O-])N2CCNCC2
Computational chemical data
  • Molecular Weight:237.259g/mol
  • Molecular Formula:C18H18N6O2
  • Compound Is Canonicalized:True
  • Exact Mass:237.111
  • Monoisotopic Mass:237.111
  • Complexity:263
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:5
  • Heavy Atom Count:17
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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