methyl 4-[[2-[(E)-2-cyano-3-oxidanylidene-3-prop-2-enoxy-prop-1-enyl]phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[2-[(E)-2-cyano-3-oxidanylidene-3-prop-2-enoxy-prop-1-enyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[2-[(E)-3-allyloxy-2-cyano-3-oxo-prop-1-enyl]phenoxy]methyl]benzoate CAS Name: 4-[[2-[(E)-2-cyano-3-oxo-3-prop-2-enoxyprop-1-enyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(E)-2-cyano-3-oxo-3-prop-2-enoxyprop-1-enyl]phenoxy]methyl]benzoate Traditional Name: 4-[[2-[(E)-3-allyloxy-2-cyano-3-keto-prop-1-enyl]phenoxy]methyl]benzoic acid methyl ester Formula: C22H19NO5 MolecularWeight: 377.38996

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2C=C(C#N)C(=O)OCC=C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2/C=C(\C#N)/C(=O)OCC=C

InChI

InChI=1S/C22H19NO5/c1-3-12-27-22(25)19(14-23)13-18-6-4-5-7-20(18)28-15-16-8-10-17(11-9-16)21(24)26-2/h3-11,13H,1,12,15H2,2H3/b19-13+