methyl 3-[3,5-bis(bromanyl)-4-methoxy-2-oxidanyl-phenyl]propanoate

Systemtic Name: methyl 3-[3,5-bis(bromanyl)-4-methoxy-2-oxidanyl-phenyl]propanoate Openeye Name: methyl 3-(3,5-dibromo-2-hydroxy-4-methoxy-phenyl)propanoate CAS Name: 3-(3,5-dibromo-2-hydroxy-4-methoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(3,5-dibromo-2-hydroxy-4-methoxyphenyl)propanoate Traditional Name: 3-(3,5-dibromo-2-hydroxy-4-methoxy-phenyl)propionic acid methyl ester Formula: C11H12Br2O4 MolecularWeight: 368.01858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1Br)O)CCC(=O)OC)Br

Isomeric SMILES

COC1=C(C=C(C(=C1Br)O)CCC(=O)OC)Br

InChI

InChI=1S/C11H12Br2O4/c1-16-8(14)4-3-6-5-7(12)11(17-2)9(13)10(6)15/h5,15H,3-4H2,1-2H3