2-[(E)-2-[4-(5-cyano-1-benzofuran-2-yl)phenyl]ethenyl]-4,6-dimethoxy-benzoic acid

Systemtic Name: 2-[(E)-2-[4-(5-cyano-1-benzofuran-2-yl)phenyl]ethenyl]-4,6-dimethoxy-benzoic acid Openeye Name: 2-[(E)-2-[4-(5-cyanobenzofuran-2-yl)phenyl]vinyl]-4,6-dimethoxy-benzoic acid CAS Name: 2-[(E)-2-[4-(5-cyano-2-benzofuranyl)phenyl]ethenyl]-4,6-dimethoxybenzoic acid IUPAC Name: 2-[(E)-2-[4-(5-cyano-1-benzofuran-2-yl)phenyl]ethenyl]-4,6-dimethoxybenzoic acid Traditional Name: 2-[(E)-2-[4-(5-cyanobenzofuran-2-yl)phenyl]vinyl]-4,6-dimethoxy-benzoic acid Formula: C26H19NO5 MolecularWeight: 425.43276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C=CC2=CC=C(C=C2)C3=CC4=C(O3)C=CC(=C4)C#N)C(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)/C=C/C2=CC=C(C=C2)C3=CC4=C(O3)C=CC(=C4)C#N)C(=O)O)OC

InChI

InChI=1S/C26H19NO5/c1-30-21-12-19(25(26(28)29)24(14-21)31-2)9-5-16-3-7-18(8-4-16)23-13-20-11-17(15-27)6-10-22(20)32-23/h3-14H,1-2H3,(H,28,29)/b9-5+