3-(3,5-dimethylphenoxy)-8-[(dipropylamino)methyl]-6-hexyl-7-oxidanyl-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 3-(3,5-dimethylphenoxy)-8-[(dipropylamino)methyl]-6-hexyl-7-oxidanyl-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(3,5-dimethylphenoxy)-8-[(dipropylamino)methyl]-6-hexyl-7-hydroxy-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(3,5-dimethylphenoxy)-8-[(dipropylamino)methyl]-6-hexyl-7-hydroxy-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(3,5-dimethylphenoxy)-8-[(dipropylamino)methyl]-6-hexyl-7-hydroxy-2-(trifluoromethyl)chromen-4-one Traditional Name: 3-(3,5-dimethylphenoxy)-8-[(dipropylamino)methyl]-6-hexyl-7-hydroxy-2-(trifluoromethyl)chromone Formula: C31H40F3NO4 MolecularWeight: 547.64881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC(=CC(=C3)C)C)CN(CCC)CCC)O

Isomeric SMILES

CCCCCCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC(=CC(=C3)C)C)CN(CCC)CCC)O

InChI

InChI=1S/C31H40F3NO4/c1-6-9-10-11-12-22-18-24-27(37)29(38-23-16-20(4)15-21(5)17-23)30(31(32,33)34)39-28(24)25(26(22)36)19-35(13-7-2)14-8-3/h15-18,36H,6-14,19H2,1-5H3