7-[(4-tert-butylphenyl)methoxy]-3-(2-chloranylphenoxy)-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 7-[(4-tert-butylphenyl)methoxy]-3-(2-chloranylphenoxy)-2-(trifluoromethyl)chromen-4-one Openeye Name: 7-[(4-tert-butylphenyl)methoxy]-3-(2-chlorophenoxy)-2-(trifluoromethyl)chromen-4-one CAS Name: 7-[(4-tert-butylphenyl)methoxy]-3-(2-chlorophenoxy)-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 7-[(4-tert-butylphenyl)methoxy]-3-(2-chlorophenoxy)-2-(trifluoromethyl)chromen-4-one Traditional Name: 7-(4-tert-butylbenzyl)oxy-3-(2-chlorophenoxy)-2-(trifluoromethyl)chromone Formula: C27H22ClF3O4 MolecularWeight: 502.90939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4Cl

InChI

InChI=1S/C27H22ClF3O4/c1-26(2,3)17-10-8-16(9-11-17)15-33-18-12-13-19-22(14-18)35-25(27(29,30)31)24(23(19)32)34-21-7-5-4-6-20(21)28/h4-14H,15H2,1-3H3