[3-(4-methylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 2-methylbenzoate

Systemtic Name: [3-(4-methylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 2-methylbenzoate Openeye Name: [3-(4-methylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [3-(4-methylphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-methylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [4-keto-3-(4-methylphenoxy)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C25H17F3O5 MolecularWeight: 454.39469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=CC=C4C)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=CC=C4C)C(F)(F)F

InChI

InChI=1S/C25H17F3O5/c1-14-7-9-16(10-8-14)31-22-21(29)19-12-11-17(13-20(19)33-23(22)25(26,27)28)32-24(30)18-6-4-3-5-15(18)2/h3-13H,1-2H3