7-butoxy-3-(3-methylphenoxy)-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 7-butoxy-3-(3-methylphenoxy)-2-(trifluoromethyl)chromen-4-one Openeye Name: 7-butoxy-3-(3-methylphenoxy)-2-(trifluoromethyl)chromen-4-one CAS Name: 7-butoxy-3-(3-methylphenoxy)-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 7-butoxy-3-(3-methylphenoxy)-2-(trifluoromethyl)chromen-4-one Traditional Name: 7-butoxy-3-(3-methylphenoxy)-2-(trifluoromethyl)chromone Formula: C21H19F3O4 MolecularWeight: 392.36837

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=CC(=C3)C

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=CC(=C3)C

InChI

InChI=1S/C21H19F3O4/c1-3-4-10-26-14-8-9-16-17(12-14)28-20(21(22,23)24)19(18(16)25)27-15-7-5-6-13(2)11-15/h5-9,11-12H,3-4,10H2,1-2H3