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

Systemtic Name: 5-[[4-[2-cyano-3-[(3-ethoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-[2-cyano-3-(3-ethoxyanilino)-3-oxo-prop-1-enyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-[2-cyano-3-(3-ethoxyanilino)-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-[2-cyano-3-(3-ethoxyanilino)-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-[2-cyano-3-keto-3-(m-phenetidino)prop-1-enyl]-2-ethoxy-phenoxy]methyl]-2-furoic acid Formula: C26H24N2O7 MolecularWeight: 476.47796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(O3)C(=O)O)OCC)C#N

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(O3)C(=O)O)OCC)C#N

InChI

InChI=1S/C26H24N2O7/c1-3-32-20-7-5-6-19(14-20)28-25(29)18(15-27)12-17-8-10-22(24(13-17)33-4-2)34-16-21-9-11-23(35-21)26(30)31/h5-14H,3-4,16H2,1-2H3,(H,28,29)(H,30,31)