3-hexyl-4-methyl-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one

Systemtic Name: 3-hexyl-4-methyl-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one Openeye Name: 3-hexyl-4-methyl-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one CAS Name: 3-hexyl-4-methyl-7-[[3-(trifluoromethyl)phenyl]methoxy]-1-benzopyran-2-one IUPAC Name: 3-hexyl-4-methyl-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one Traditional Name: 3-hexyl-4-methyl-7-[3-(trifluoromethyl)benzyl]oxy-coumarin Formula: C24H25F3O3 MolecularWeight: 418.44871

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C(C=C2)OCC3=CC(=CC=C3)C(F)(F)F)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C(C=C2)OCC3=CC(=CC=C3)C(F)(F)F)OC1=O)C

InChI

InChI=1S/C24H25F3O3/c1-3-4-5-6-10-21-16(2)20-12-11-19(14-22(20)30-23(21)28)29-15-17-8-7-9-18(13-17)24(25,26)27/h7-9,11-14H,3-6,10,15H2,1-2H3