4,7-dimethyl-3-(phenylmethyl)-5-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one

Systemtic Name: 4,7-dimethyl-3-(phenylmethyl)-5-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one Openeye Name: 3-benzyl-4,7-dimethyl-5-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one CAS Name: 4,7-dimethyl-3-(phenylmethyl)-5-[[3-(trifluoromethyl)phenyl]methoxy]-1-benzopyran-2-one IUPAC Name: 3-benzyl-4,7-dimethyl-5-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one Traditional Name: 3-benzyl-4,7-dimethyl-5-[3-(trifluoromethyl)benzyl]oxy-coumarin Formula: C26H21F3O3 MolecularWeight: 438.43835

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C26H21F3O3/c1-16-11-22(31-15-19-9-6-10-20(13-19)26(27,28)29)24-17(2)21(25(30)32-23(24)12-16)14-18-7-4-3-5-8-18/h3-13H,14-15H2,1-2H3