(E)-2-cyano-3-(2,4,5-trimethoxyphenyl)prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(2,4,5-trimethoxyphenyl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(2,4,5-trimethoxyphenyl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(2,4,5-trimethoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(2,4,5-trimethoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-asaryl-2-cyano-acrylic acid Formula: C13H13NO5 MolecularWeight: 263.24602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO5/c1-17-10-6-12(19-3)11(18-2)5-8(10)4-9(7-14)13(15)16/h4-6H,1-3H3,(H,15,16)/b9-4+