60R

6-[(~{E})-(3-fluoranyl-6~{H}-benzo[c][1]benzoxepin-11-ylidene)methyl]-4~{H}-1,4-benzoxazin-3-one


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Chemical Component Summary

Name6-[(~{E})-(3-fluoranyl-6~{H}-benzo[c][1]benzoxepin-11-ylidene)methyl]-4~{H}-1,4-benzoxazin-3-one
Identifiers6-[(~{E})-(3-fluoranyl-6~{H}-benzo[c][1]benzoxepin-11-ylidene)methyl]-4~{H}-1,4-benzoxazin-3-one
FormulaC23 H16 F N O3
Molecular Weight373.376
TypeNON-POLYMER
Isomeric SMILESc1ccc\2c(c1)COc3cc(ccc3/C2=C/c4ccc5c(c4)NC(=O)CO5)F
InChIInChI=1S/C23H16FNO3/c24-16-6-7-18-19(17-4-2-1-3-15(17)12-27-22(18)11-16)9-14-5-8-21-20(10-14)25-23(26)13-28-21/h1-11H,12-13H2,(H,25,26)/b19-9+
InChIKeyIGQHIUNZKLGBMZ-DJKKODMXSA-N

Chemical Details

Formal Charge0
Atom Count44
Chiral Atom Count0
Bond Count48
Aromatic Bond Count18

Related Resource References

Resource NameReference
Pharos CHEMBL3775752
PubChem 118796369
ChEMBL CHEMBL3775752