[4-[(E)-2-cyano-3-oxidanylidene-3-(phenethylamino)prop-1-enyl]-2-methoxy-phenyl] furan-2-carboxylate

Systemtic Name: [4-[(E)-2-cyano-3-oxidanylidene-3-(phenethylamino)prop-1-enyl]-2-methoxy-phenyl] furan-2-carboxylate Openeye Name: [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxy-phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[(E)-2-cyano-3-keto-3-(phenethylamino)prop-1-enyl]-2-methoxy-phenyl] ester Formula: C24H20N2O5 MolecularWeight: 416.426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NCCC2=CC=CC=C2)OC(=O)C3=CC=CO3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NCCC2=CC=CC=C2)OC(=O)C3=CC=CO3

InChI

InChI=1S/C24H20N2O5/c1-29-22-15-18(9-10-20(22)31-24(28)21-8-5-13-30-21)14-19(16-25)23(27)26-12-11-17-6-3-2-4-7-17/h2-10,13-15H,11-12H2,1H3,(H,26,27)/b19-14+