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

Systemtic Name: (E)-2-cyano-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxy-phenyl)acrylic acid Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C=C(C#N)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C12H11NO5/c1-17-9-4-7(3-8(6-13)12(15)16)5-10(18-2)11(9)14/h3-5,14H,1-2H3,(H,15,16)/b8-3+