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Chemistry

Mol. Mass

348.51

ALogP

3.48

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC[N+](C)(CC)CCOC(=O)C(O)(c1ccccc1)C1CCCCC1
  • InChIKey: GFRUPHOKLBPHTQ-UHFFFAOYSA-N
    InChI=1S/C21H34NO3/c1-4-22(3,5-2)16-17-25-20(23)21(24,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6,8-9,12-13,19,24H,4-5,7,10-11,14-17H2,1-3H3/q+1
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1201286   ChEMBL
oxyphenonium *

CHEMBL1200906   ChEMBL
oxyphenonium bromide

D2G5508Y7I   NCATS
oxyphenonium *

Oxyphenonium bromide   Wikipedia

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