3-(4-Ethylphenoxy)-4-oxo-4H-chromen-7-yl 3,4,5-triethoxybenzoate

ChemSpider ID: 1354315
Molecular Formula: C₃₀H₃₀O₈
Average mass: 518.554382 Da
Monoisotopic mass: 518.194092 Da
Systematic name

3-(4-Ethylphenoxy)-4-oxo-4H-chromen-7-yl 3,4,5-triethoxybenzoate
SMILES and InChIs

SMILES:

O=C(Oc3ccc2c(O/C=C(/Oc1ccc(cc1)CC)C2=O)c3)c4cc(OCC)c(OCC)c(OCC)c4 Copied

Std. InChI:

InChI=1S/C30H30O8/c1-5-19-9-11-21(12-10-19)37-27-18-36-24-17-22(13-14-23(24)28(27)31)38-30(32)20-15-25(33-6-2)29(35-8-4)26(16-20)34-7-3/h9-18H,5-8H2,1-4H3 Copied

Std. InChIKey:

IPNMEZPFPMBTJE-UHFFFAOYSA-N Copied
Cite this record
CSID:1354315, http://www.chemspider.com/Chemical-Structure.1354315.html (accessed 18:01, May 19, 2013) Copied

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Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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