3-(4-tert-butylphenoxy)-7-[(4-nitrophenyl)methoxy]-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 3-(4-tert-butylphenoxy)-7-[(4-nitrophenyl)methoxy]-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(4-tert-butylphenoxy)-7-[(4-nitrophenyl)methoxy]-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(4-tert-butylphenoxy)-7-[(4-nitrophenyl)methoxy]-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(4-tert-butylphenoxy)-7-[(4-nitrophenyl)methoxy]-2-(trifluoromethyl)chromen-4-one Traditional Name: 3-(4-tert-butylphenoxy)-7-(4-nitrobenzyl)oxy-2-(trifluoromethyl)chromone Formula: C27H22F3NO6 MolecularWeight: 513.46189

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H22F3NO6/c1-26(2,3)17-6-10-19(11-7-17)36-24-23(32)21-13-12-20(14-22(21)37-25(24)27(28,29)30)35-15-16-4-8-18(9-5-16)31(33)34/h4-14H,15H2,1-3H3