[3-(2-ethoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [3-(2-ethoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [3-(2-ethoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [3-(2-ethoxyphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-ethoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [3-(2-ethoxyphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C26H17F3O8 MolecularWeight: 514.40359

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC5=C(C=C4)OCO5)C(F)(F)F

Isomeric SMILES

CCOC1=CC=CC=C1OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC5=C(C=C4)OCO5)C(F)(F)F

InChI

InChI=1S/C26H17F3O8/c1-2-32-17-5-3-4-6-19(17)36-23-22(30)16-9-8-15(12-20(16)37-24(23)26(27,28)29)35-25(31)14-7-10-18-21(11-14)34-13-33-18/h3-12H,2,13H2,1H3