[3-(2-ethoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-phenylbenzoate

Systemtic Name: [3-(2-ethoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-phenylbenzoate Openeye Name: [3-(2-ethoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid [3-(2-ethoxyphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-ethoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid [3-(2-ethoxyphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C31H21F3O6 MolecularWeight: 546.49005

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)C5=CC=CC=C5)C(F)(F)F

Isomeric SMILES

CCOC1=CC=CC=C1OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)C5=CC=CC=C5)C(F)(F)F

InChI

InChI=1S/C31H21F3O6/c1-2-37-24-10-6-7-11-25(24)39-28-27(35)23-17-16-22(18-26(23)40-29(28)31(32,33)34)38-30(36)21-14-12-20(13-15-21)19-8-4-3-5-9-19/h3-18H,2H2,1H3