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

Systemtic Name: 3-(3,5-dimethylphenoxy)-7-[(3-methylphenyl)methoxy]-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(3,5-dimethylphenoxy)-7-(m-tolylmethoxy)-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(3,5-dimethylphenoxy)-7-[(3-methylphenyl)methoxy]-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(3,5-dimethylphenoxy)-7-[(3-methylphenyl)methoxy]-2-(trifluoromethyl)chromen-4-one Traditional Name: 3-(3,5-dimethylphenoxy)-7-(3-methylbenzyl)oxy-2-(trifluoromethyl)chromone Formula: C26H21F3O4 MolecularWeight: 454.43775

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC(=CC(=C4)C)C

Isomeric SMILES

CC1=CC(=CC=C1)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC(=CC(=C4)C)C

InChI

InChI=1S/C26H21F3O4/c1-15-5-4-6-18(10-15)14-31-19-7-8-21-22(13-19)33-25(26(27,28)29)24(23(21)30)32-20-11-16(2)9-17(3)12-20/h4-13H,14H2,1-3H3