3-(4-tert-butylphenoxy)-7-[(3-chlorophenyl)methoxy]-2-(trifluoromethyl)chromen-4-one

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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