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

Systemtic Name: 5-[[4-[2-cyano-3-[(3,4-dichlorophenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-[2-cyano-3-(3,4-dichloroanilino)-3-oxo-prop-1-enyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-[2-cyano-3-(3,4-dichloroanilino)-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-[2-cyano-3-(3,4-dichloroanilino)-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-[2-cyano-3-(3,4-dichloroanilino)-3-keto-prop-1-enyl]-2-ethoxy-phenoxy]methyl]-2-furoic acid Formula: C24H18Cl2N2O6 MolecularWeight: 501.31552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC(=C(C=C2)Cl)Cl)OCC3=CC=C(O3)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC(=C(C=C2)Cl)Cl)OCC3=CC=C(O3)C(=O)O

InChI

InChI=1S/C24H18Cl2N2O6/c1-2-32-22-10-14(3-7-20(22)33-13-17-5-8-21(34-17)24(30)31)9-15(12-27)23(29)28-16-4-6-18(25)19(26)11-16/h3-11H,2,13H2,1H3,(H,28,29)(H,30,31)