methyl 4-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]butanoate Openeye Name: methyl 4-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]butanoate CAS Name: 4-[[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]butanoate Traditional Name: 4-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]butyric acid methyl ester Formula: C13H15BrFNO4 MolecularWeight: 348.164903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)COC1=C(C=C(C=C1)Br)F

Isomeric SMILES

COC(=O)CCCNC(=O)COC1=C(C=C(C=C1)Br)F

InChI

InChI=1S/C13H15BrFNO4/c1-19-13(18)3-2-6-16-12(17)8-20-11-5-4-9(14)7-10(11)15/h4-5,7H,2-3,6,8H2,1H3,(H,16,17)