(phenylmethyl) 2-[3-(4-ethylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate

Systemtic Name: (phenylmethyl) 2-[3-(4-ethylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate Openeye Name: benzyl 2-[3-(4-ethylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate CAS Name: 2-[[3-(4-ethylphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-(4-ethylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate Traditional Name: 2-[3-(4-ethylphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxyacetic acid benzyl ester Formula: C27H21F3O6 MolecularWeight: 498.44725

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC(=O)OCC4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC(=O)OCC4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C27H21F3O6/c1-2-17-8-10-19(11-9-17)35-25-24(32)21-13-12-20(14-22(21)36-26(25)27(28,29)30)33-16-23(31)34-15-18-6-4-3-5-7-18/h3-14H,2,15-16H2,1H3