(E)-3-[5-bromanyl-2-(cyanomethoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-bromanyl-2-(cyanomethoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[5-bromo-2-(cyanomethoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[5-bromo-2-(cyanomethoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[5-bromo-2-(cyanomethoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[5-bromo-2-(cyanomethoxy)phenyl]acrylic acid Formula: C11H8BrNO3 MolecularWeight: 282.09012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C=CC(=O)O)OCC#N

Isomeric SMILES

C1=CC(=C(C=C1Br)/C=C/C(=O)O)OCC#N

InChI

InChI=1S/C11H8BrNO3/c12-9-2-3-10(16-6-5-13)8(7-9)1-4-11(14)15/h1-4,7H,6H2,(H,14,15)/b4-1+