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

Systemtic Name: 5-[[4-[2-cyano-3-(methylamino)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-[2-cyano-3-(methylamino)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-[2-cyano-3-(methylamino)-3-oxoprop-1-enyl]-2-methoxyphenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-[2-cyano-3-(methylamino)-3-oxoprop-1-enyl]-2-methoxyphenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-[2-cyano-3-keto-3-(methylamino)prop-1-enyl]-2-methoxy-phenoxy]methyl]-2-furoic acid Formula: C18H16N2O6 MolecularWeight: 356.32944

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)O)OC)C#N

Isomeric SMILES

CNC(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)O)OC)C#N

InChI

InChI=1S/C18H16N2O6/c1-20-17(21)12(9-19)7-11-3-5-14(16(8-11)24-2)25-10-13-4-6-15(26-13)18(22)23/h3-8H,10H2,1-2H3,(H,20,21)(H,22,23)