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3-(1-Naphthyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-phenoxybutanoate

ChemSpider ID: 23520084
Molecular Formula: C₃₀H₂₁F₃O₅
Average mass: 518.479919 Da
Monoisotopic mass: 518.134094 Da
Systematic name

3-(1-Naphthyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-phenoxybutanoate
SMILES and InChIs

SMILES:

c1ccc(cc1)OCCCC(=O)Oc2ccc3c(c2)oc(c(c3=O)c4cccc5c4cccc5)C(F)(F)F Copied

Std. InChI:

InChI=1S/C30H21F3O5/c31-30(32,33)29-27(23-13-6-9-19-8-4-5-12-22(19)23)28(35)24-16-15-21(18-25(24)38-29)37-26(34)14-7-17-36-20-10-2-1-3-11-20/h1-6,8-13,15-16,18H,7,14,17H2 Copied

Std. InChIKey:

HSWVNIOBBSINAG-UHFFFAOYSA-N Copied
Cite this record
CSID:23520084, http://www.chemspider.com/Chemical-Structure.23520084.html (accessed 08:43, May 25, 2012) Copied

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

Click to predict properties on the Chemicalize site

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