methyl 4-[(1E,4E)-5-(4-methoxycarbonylphenyl)-3-oxidanylidene-penta-1,4-dienyl]benzoate

Systemtic Name: methyl 4-[(1E,4E)-5-(4-methoxycarbonylphenyl)-3-oxidanylidene-penta-1,4-dienyl]benzoate Openeye Name: methyl 4-[(1E,4E)-5-(4-methoxycarbonylphenyl)-3-oxo-penta-1,4-dienyl]benzoate CAS Name: 4-[(1E,4E)-5-(4-methoxycarbonylphenyl)-3-oxopenta-1,4-dienyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(1E,4E)-5-(4-methoxycarbonylphenyl)-3-oxopenta-1,4-dienyl]benzoate Traditional Name: 4-[(1E,4E)-5-(4-carbomethoxyphenyl)-3-keto-penta-1,4-dienyl]benzoic acid methyl ester Formula: C21H18O5 MolecularWeight: 350.36462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)C=CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)/C=C/C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H18O5/c1-25-20(23)17-9-3-15(4-10-17)7-13-19(22)14-8-16-5-11-18(12-6-16)21(24)26-2/h3-14H,1-2H3/b13-7+,14-8+