3-(4-chloranyl-3,5-dimethyl-phenoxy)-8-(dimethylaminomethyl)-7-oxidanyl-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 3-(4-chloranyl-3,5-dimethyl-phenoxy)-8-(dimethylaminomethyl)-7-oxidanyl-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(4-chloro-3,5-dimethyl-phenoxy)-8-(dimethylaminomethyl)-7-hydroxy-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(4-chloro-3,5-dimethylphenoxy)-8-(dimethylaminomethyl)-7-hydroxy-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(4-chloro-3,5-dimethylphenoxy)-8-(dimethylaminomethyl)-7-hydroxy-2-(trifluoromethyl)chromen-4-one Traditional Name: 3-(4-chloro-3,5-dimethyl-phenoxy)-8-(dimethylaminomethyl)-7-hydroxy-2-(trifluoromethyl)chromone Formula: C21H19ClF3NO4 MolecularWeight: 441.82807

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=C(OC3=C(C2=O)C=CC(=C3CN(C)C)O)C(F)(F)F

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=C(OC3=C(C2=O)C=CC(=C3CN(C)C)O)C(F)(F)F

InChI

InChI=1S/C21H19ClF3NO4/c1-10-7-12(8-11(2)16(10)22)29-19-17(28)13-5-6-15(27)14(9-26(3)4)18(13)30-20(19)21(23,24)25/h5-8,27H,9H2,1-4H3