5-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[(2-bromo-4-chloro-phenoxy)methyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[(2-bromo-4-chlorophenoxy)methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[(2-bromo-4-chlorophenoxy)methyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[(2-bromo-4-chloro-phenoxy)methyl]-2-methyl-3-furoic acid Formula: C13H10BrClO4 MolecularWeight: 345.5731

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)COC2=C(C=C(C=C2)Cl)Br)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)COC2=C(C=C(C=C2)Cl)Br)C(=O)O

InChI

InChI=1S/C13H10BrClO4/c1-7-10(13(16)17)5-9(19-7)6-18-12-3-2-8(15)4-11(12)14/h2-5H,6H2,1H3,(H,16,17)