5-[[4-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[4-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-[2-cyano-2-(2,4-dichlorophenyl)vinyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-2-ethoxyphenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-[2-cyano-2-(2,4-dichlorophenyl)ethenyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-[2-cyano-2-(2,4-dichlorophenyl)vinyl]-2-ethoxy-phenoxy]methyl]-2-furoic acid Formula: C23H17Cl2NO5 MolecularWeight: 458.29078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C2=C(C=C(C=C2)Cl)Cl)OCC3=CC=C(O3)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C2=C(C=C(C=C2)Cl)Cl)OCC3=CC=C(O3)C(=O)O

InChI

InChI=1S/C23H17Cl2NO5/c1-2-29-22-10-14(9-15(12-26)18-6-4-16(24)11-19(18)25)3-7-20(22)30-13-17-5-8-21(31-17)23(27)28/h3-11H,2,13H2,1H3,(H,27,28)