7-methyl-4-[[2-(trifluoromethyl)phenoxy]methyl]chromen-2-one

Systemtic Name: 7-methyl-4-[[2-(trifluoromethyl)phenoxy]methyl]chromen-2-one Openeye Name: 7-methyl-4-[[2-(trifluoromethyl)phenoxy]methyl]chromen-2-one CAS Name: 7-methyl-4-[[2-(trifluoromethyl)phenoxy]methyl]-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[[2-(trifluoromethyl)phenoxy]methyl]chromen-2-one Traditional Name: 7-methyl-4-[[2-(trifluoromethyl)phenoxy]methyl]coumarin Formula: C18H13F3O3 MolecularWeight: 334.28923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C18H13F3O3/c1-11-6-7-13-12(9-17(22)24-16(13)8-11)10-23-15-5-3-2-4-14(15)18(19,20)21/h2-9H,10H2,1H3