3-(2-tert-butyl-4-ethyl-phenoxy)-7-oxidanyl-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 3-(2-tert-butyl-4-ethyl-phenoxy)-7-oxidanyl-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(2-tert-butyl-4-ethyl-phenoxy)-7-hydroxy-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(2-tert-butyl-4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(2-tert-butyl-4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)chromen-4-one Traditional Name: 3-(2-tert-butyl-4-ethyl-phenoxy)-7-hydroxy-2-(trifluoromethyl)chromone Formula: C22H21F3O4 MolecularWeight: 406.39495

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)O)C(F)(F)F)C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)O)C(F)(F)F)C(C)(C)C

InChI

InChI=1S/C22H21F3O4/c1-5-12-6-9-16(15(10-12)21(2,3)4)28-19-18(27)14-8-7-13(26)11-17(14)29-20(19)22(23,24)25/h6-11,26H,5H2,1-4H3