(E)-3-[5-bromanyl-2-(2-ethoxy-2-oxidanylidene-ethoxy)-3-iodanyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-bromanyl-2-(2-ethoxy-2-oxidanylidene-ethoxy)-3-iodanyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[5-bromo-2-(2-ethoxy-2-oxo-ethoxy)-3-iodo-phenyl]prop-2-enoic acid CAS Name: (E)-3-[5-bromo-2-(2-ethoxy-2-oxoethoxy)-3-iodophenyl]-2-propenoic acid IUPAC Name: (E)-3-[5-bromo-2-(2-ethoxy-2-oxoethoxy)-3-iodophenyl]prop-2-enoic acid Traditional Name: (E)-3-[5-bromo-2-(2-ethoxy-2-keto-ethoxy)-3-iodo-phenyl]acrylic acid Formula: C13H12BrIO5 MolecularWeight: 455.03985

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1C=CC(=O)O)Br)I

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1/C=C/C(=O)O)Br)I

InChI

InChI=1S/C13H12BrIO5/c1-2-19-12(18)7-20-13-8(3-4-11(16)17)5-9(14)6-10(13)15/h3-6H,2,7H2,1H3,(H,16,17)/b4-3+