3-(2,5-dimethylphenoxy)-7-[(4-nitrophenyl)methoxy]-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 3-(2,5-dimethylphenoxy)-7-[(4-nitrophenyl)methoxy]-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(2,5-dimethylphenoxy)-7-[(4-nitrophenyl)methoxy]-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(2,5-dimethylphenoxy)-7-[(4-nitrophenyl)methoxy]-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(2,5-dimethylphenoxy)-7-[(4-nitrophenyl)methoxy]-2-(trifluoromethyl)chromen-4-one Traditional Name: 3-(2,5-dimethylphenoxy)-7-(4-nitrobenzyl)oxy-2-(trifluoromethyl)chromone Formula: C25H18F3NO6 MolecularWeight: 485.40873

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C25H18F3NO6/c1-14-3-4-15(2)20(11-14)34-23-22(30)19-10-9-18(12-21(19)35-24(23)25(26,27)28)33-13-16-5-7-17(8-6-16)29(31)32/h3-12H,13H2,1-2H3