(4-bromanyl-2-fluoranyl-phenyl)methyl 3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 3-(3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzoxazin-4-yl)propanoic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 3-(3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)propionic acid (4-bromo-2-fluoro-benzyl) ester Formula: C18H15BrFNO4 MolecularWeight: 408.218403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2O1)CCC(=O)OCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2O1)CCC(=O)OCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C18H15BrFNO4/c19-13-6-5-12(14(20)9-13)10-25-18(23)7-8-21-15-3-1-2-4-16(15)24-11-17(21)22/h1-6,9H,7-8,10-11H2