5-[[4-[2-cyano-3-(2-methoxyethoxy)-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[4-[2-cyano-3-(2-methoxyethoxy)-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-[2-cyano-3-(2-methoxyethoxy)-3-oxo-prop-1-enyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-[2-cyano-3-(2-methoxyethoxy)-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-[2-cyano-3-(2-methoxyethoxy)-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-[2-cyano-3-keto-3-(2-methoxyethoxy)prop-1-enyl]-2-ethoxy-phenoxy]methyl]-2-furoic acid Formula: C21H21NO8 MolecularWeight: 415.39334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)OCCOC)OCC2=CC=C(O2)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)OCCOC)OCC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C21H21NO8/c1-3-27-19-11-14(10-15(12-22)21(25)28-9-8-26-2)4-6-17(19)29-13-16-5-7-18(30-16)20(23)24/h4-7,10-11H,3,8-9,13H2,1-2H3,(H,23,24)