(Z)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-2-cyano-prop-2-enoic acid

Systemtic Name: (Z)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-2-cyano-prop-2-enoic acid Openeye Name: (Z)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-2-cyano-prop-2-enoic acid CAS Name: (Z)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-2-cyano-2-propenoic acid IUPAC Name: (Z)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-2-cyanoprop-2-enoic acid Traditional Name: (Z)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-2-cyano-acrylic acid Formula: C13H12BrNO4 MolecularWeight: 326.14268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12BrNO4/c1-3-19-11-6-8(4-9(7-15)13(16)17)5-10(14)12(11)18-2/h4-6H,3H2,1-2H3,(H,16,17)/b9-4-