(E)-3-(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)-2-cyano-prop-2-enoic acid

Systemtic Name: (E)-3-(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)-2-cyano-prop-2-enoic acid Openeye Name: (E)-3-(4-allyloxy-3-bromo-5-ethoxy-phenyl)-2-cyano-prop-2-enoic acid CAS Name: (E)-3-(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)-2-cyano-2-propenoic acid IUPAC Name: (E)-3-(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)-2-cyanoprop-2-enoic acid Traditional Name: (E)-3-(4-allyloxy-3-bromo-5-ethoxy-phenyl)-2-cyano-acrylic acid Formula: C15H14BrNO4 MolecularWeight: 352.17996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)O)Br)OCC=C

InChI

InChI=1S/C15H14BrNO4/c1-3-5-21-14-12(16)7-10(8-13(14)20-4-2)6-11(9-17)15(18)19/h3,6-8H,1,4-5H2,2H3,(H,18,19)/b11-6+