3-(4-chlorophenyl)-7-pentoxy-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 3-(4-chlorophenyl)-7-pentoxy-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(4-chlorophenyl)-7-pentoxy-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(4-chlorophenyl)-7-pentoxy-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(4-chlorophenyl)-7-pentoxy-2-(trifluoromethyl)chromen-4-one Traditional Name: 7-amoxy-3-(4-chlorophenyl)-2-(trifluoromethyl)chromone Formula: C21H18ClF3O3 MolecularWeight: 410.81403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H18ClF3O3/c1-2-3-4-11-27-15-9-10-16-17(12-15)28-20(21(23,24)25)18(19(16)26)13-5-7-14(22)8-6-13/h5-10,12H,2-4,11H2,1H3