(E)-3-[2-bromanyl-4-(cyanomethoxy)-5-ethoxy-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[2-bromanyl-4-(cyanomethoxy)-5-ethoxy-phenyl]prop-2-enoate Openeye Name: (E)-3-[2-bromo-4-(cyanomethoxy)-5-ethoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[2-bromo-4-(cyanomethoxy)-5-ethoxyphenyl]-2-propenoate IUPAC Name: (E)-3-[2-bromo-4-(cyanomethoxy)-5-ethoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[2-bromo-4-(cyanomethoxy)-5-ethoxy-phenyl]acrylate Formula: C13H11BrNO4- MolecularWeight: 325.13474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C=CC(=O)[O-])Br)OCC#N

Isomeric SMILES

CCOC1=C(C=C(C(=C1)/C=C/C(=O)[O-])Br)OCC#N

InChI

InChI=1S/C13H12BrNO4/c1-2-18-11-7-9(3-4-13(16)17)10(14)8-12(11)19-6-5-15/h3-4,7-8H,2,6H2,1H3,(H,16,17)/p-1/b4-3+