3-(4-chloranyl-3,5-dimethyl-phenoxy)-7-propoxy-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 3-(4-chloranyl-3,5-dimethyl-phenoxy)-7-propoxy-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(4-chloro-3,5-dimethyl-phenoxy)-7-propoxy-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(4-chloro-3,5-dimethylphenoxy)-7-propoxy-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(4-chloro-3,5-dimethylphenoxy)-7-propoxy-2-(trifluoromethyl)chromen-4-one Traditional Name: 3-(4-chloro-3,5-dimethyl-phenoxy)-7-propoxy-2-(trifluoromethyl)chromone Formula: C21H18ClF3O4 MolecularWeight: 426.81343

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC(=C(C(=C3)C)Cl)C

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC(=C(C(=C3)C)Cl)C

InChI

InChI=1S/C21H18ClF3O4/c1-4-7-27-13-5-6-15-16(10-13)29-20(21(23,24)25)19(18(15)26)28-14-8-11(2)17(22)12(3)9-14/h5-6,8-10H,4,7H2,1-3H3