1H,10H-[1,5]benzodioxepino[7,8-a]benzo[f]quinolizin-1-one, 16-(4-fluorophenyl)-2,3,4,6,7,11,12,16-octahydro-

ChemSpider ID: 21527948
Molecular Formula: C₂₆H₂₄FNO₃
Average mass: 417.471985 Da
Monoisotopic mass: 417.174011 Da
Systematic name

16-(4-Fluorophenyl)-2,3,4,6,7,11,12,16-octahydro-1H,10H-[1,4]dioxepino[2',3':6,7]isoquinolino[2,1-a]quinolin-1-one
SMILES and InChIs

SMILES:

c1cc(ccc1C2C=C3c4cc5c(cc4CCN3C6=C2C(=O)CCC6)OCCCO5)F Copied

Std. InChI:

InChI=1S/C26H24FNO3/c27-18-7-5-16(6-8-18)20-14-22-19-15-25-24(30-11-2-12-31-25)13-17(19)9-10-28(22)21-3-1-4-23(29)26(20)21/h5-8,13-15,20H,1-4,9-12H2 Copied

Std. InChIKey:

YPNMUWBCZPEHRD-UHFFFAOYSA-N Copied
Cite this record
CSID:21527948, http://www.chemspider.com/Chemical-Structure.21527948.html (accessed 15:39, Jun 19, 2013) Copied

Names and Identifiers

Data supplied by datasources and users.

Experimental Physico-chemical Properties
- Experimental LogP:
  
  4.259 Vitas-M STK613956

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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