7-[(4-bromophenyl)methoxy]-3-(2,5-dimethylphenoxy)-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 7-[(4-bromophenyl)methoxy]-3-(2,5-dimethylphenoxy)-2-(trifluoromethyl)chromen-4-one Openeye Name: 7-[(4-bromophenyl)methoxy]-3-(2,5-dimethylphenoxy)-2-(trifluoromethyl)chromen-4-one CAS Name: 7-[(4-bromophenyl)methoxy]-3-(2,5-dimethylphenoxy)-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 7-[(4-bromophenyl)methoxy]-3-(2,5-dimethylphenoxy)-2-(trifluoromethyl)chromen-4-one Traditional Name: 7-(4-bromobenzyl)oxy-3-(2,5-dimethylphenoxy)-2-(trifluoromethyl)chromone Formula: C25H18BrF3O4 MolecularWeight: 519.30723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=C(C=C4)Br)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=C(C=C4)Br)C(F)(F)F

InChI

InChI=1S/C25H18BrF3O4/c1-14-3-4-15(2)20(11-14)32-23-22(30)19-10-9-18(12-21(19)33-24(23)25(27,28)29)31-13-16-5-7-17(26)8-6-16/h3-12H,13H2,1-2H3