(E)-3-(5-bromanyl-2,4-dimethoxy-phenyl)-2-cyano-prop-2-enoic acid

Systemtic Name: (E)-3-(5-bromanyl-2,4-dimethoxy-phenyl)-2-cyano-prop-2-enoic acid Openeye Name: (E)-3-(5-bromo-2,4-dimethoxy-phenyl)-2-cyano-prop-2-enoic acid CAS Name: (E)-3-(5-bromo-2,4-dimethoxyphenyl)-2-cyano-2-propenoic acid IUPAC Name: (E)-3-(5-bromo-2,4-dimethoxyphenyl)-2-cyanoprop-2-enoic acid Traditional Name: (E)-3-(5-bromo-2,4-dimethoxy-phenyl)-2-cyano-acrylic acid Formula: C12H10BrNO4 MolecularWeight: 312.1161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=C(C#N)C(=O)O)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C(\C#N)/C(=O)O)Br)OC

InChI

InChI=1S/C12H10BrNO4/c1-17-10-5-11(18-2)9(13)4-7(10)3-8(6-14)12(15)16/h3-5H,1-2H3,(H,15,16)/b8-3+