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

Systemtic Name: [4-oxidanylidene-3-phenyl-2-(trifluoromethyl)chromen-7-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [4-oxo-3-phenyl-2-(trifluoromethyl)chromen-7-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [4-oxo-3-phenyl-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-phenyl-2-(trifluoromethyl)chromen-7-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [4-keto-3-phenyl-2-(trifluoromethyl)chromen-7-yl] ester Formula: C24H13F3O6 MolecularWeight: 454.35163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=C(O4)C(F)(F)F)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=C(O4)C(F)(F)F)C5=CC=CC=C5

InChI

InChI=1S/C24H13F3O6/c25-24(26,27)22-20(13-4-2-1-3-5-13)21(28)16-8-7-15(11-18(16)33-22)32-23(29)14-6-9-17-19(10-14)31-12-30-17/h1-11H,12H2