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

Systemtic Name: 5-[[4-[2-cyano-3-[(4-ethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-[2-cyano-3-(4-ethylanilino)-3-oxo-prop-1-enyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-[2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-[2-cyano-3-(4-ethylanilino)-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-[2-cyano-3-(4-ethylanilino)-3-keto-prop-1-enyl]-2-ethoxy-phenoxy]methyl]-2-furoic acid Formula: C26H24N2O6 MolecularWeight: 460.47856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(O3)C(=O)O)OCC)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(O3)C(=O)O)OCC)C#N

InChI

InChI=1S/C26H24N2O6/c1-3-17-5-8-20(9-6-17)28-25(29)19(15-27)13-18-7-11-22(24(14-18)32-4-2)33-16-21-10-12-23(34-21)26(30)31/h5-14H,3-4,16H2,1-2H3,(H,28,29)(H,30,31)