[3-(2-bromanylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3,4-dimethoxybenzoate

Systemtic Name: [3-(2-bromanylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3,4-dimethoxybenzoate Openeye Name: [3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [3-(2-bromophenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C25H16BrF3O7 MolecularWeight: 565.28955

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4Br)OC

InChI

InChI=1S/C25H16BrF3O7/c1-32-18-10-7-13(11-20(18)33-2)24(31)34-14-8-9-15-19(12-14)36-23(25(27,28)29)22(21(15)30)35-17-6-4-3-5-16(17)26/h3-12H,1-2H3