2-[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]-N-(4-bromanyl-2-fluoranyl-phenyl)ethanamide

Systemtic Name: 2-[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]-N-(4-bromanyl-2-fluoranyl-phenyl)ethanamide Openeye Name: 2-[5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]-N-(4-bromo-2-fluoro-phenyl)acetamide CAS Name: 2-[5-(1,3-benzodioxol-5-yl)-3-isoxazolyl]-N-(4-bromo-2-fluorophenyl)acetamide IUPAC Name: 2-[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]-N-(4-bromo-2-fluorophenyl)acetamide Traditional Name: 2-[5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]-N-(4-bromo-2-fluoro-phenyl)acetamide Formula: C18H12BrFN2O4 MolecularWeight: 419.201283

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=NO3)CC(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=NO3)CC(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C18H12BrFN2O4/c19-11-2-3-14(13(20)6-11)21-18(23)8-12-7-16(26-22-12)10-1-4-15-17(5-10)25-9-24-15/h1-7H,8-9H2,(H,21,23)