8-(diethylaminomethyl)-3-(3,5-dimethylphenoxy)-6-hexyl-7-oxidanyl-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 8-(diethylaminomethyl)-3-(3,5-dimethylphenoxy)-6-hexyl-7-oxidanyl-2-(trifluoromethyl)chromen-4-one Openeye Name: 8-(diethylaminomethyl)-3-(3,5-dimethylphenoxy)-6-hexyl-7-hydroxy-2-(trifluoromethyl)chromen-4-one CAS Name: 8-(diethylaminomethyl)-3-(3,5-dimethylphenoxy)-6-hexyl-7-hydroxy-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 8-(diethylaminomethyl)-3-(3,5-dimethylphenoxy)-6-hexyl-7-hydroxy-2-(trifluoromethyl)chromen-4-one Traditional Name: 8-(diethylaminomethyl)-3-(3,5-dimethylphenoxy)-6-hexyl-7-hydroxy-2-(trifluoromethyl)chromone Formula: C29H36F3NO4 MolecularWeight: 519.59565

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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(CC)CC)O

Isomeric SMILES

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

InChI

InChI=1S/C29H36F3NO4/c1-6-9-10-11-12-20-16-22-25(35)27(36-21-14-18(4)13-19(5)15-21)28(29(30,31)32)37-26(22)23(24(20)34)17-33(7-2)8-3/h13-16,34H,6-12,17H2,1-5H3