4-butyl-8-methyl-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one

Systemtic Name: 4-butyl-8-methyl-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one Openeye Name: 4-butyl-8-methyl-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one CAS Name: 4-butyl-8-methyl-7-[[3-(trifluoromethyl)phenyl]methoxy]-1-benzopyran-2-one IUPAC Name: 4-butyl-8-methyl-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one Traditional Name: 4-butyl-8-methyl-7-[3-(trifluoromethyl)benzyl]oxy-coumarin Formula: C22H21F3O3 MolecularWeight: 390.39555

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C22H21F3O3/c1-3-4-7-16-12-20(26)28-21-14(2)19(10-9-18(16)21)27-13-15-6-5-8-17(11-15)22(23,24)25/h5-6,8-12H,3-4,7,13H2,1-2H3