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

Systemtic Name: [3-(4-methoxycarbonylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-methylbenzoate Openeye Name: [3-(4-methoxycarbonylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [3-(4-methoxycarbonylphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-methoxycarbonylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [3-(4-carbomethoxyphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C26H17F3O7 MolecularWeight: 498.40419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C26H17F3O7/c1-14-3-5-16(6-4-14)25(32)35-18-11-12-19-20(13-18)36-23(26(27,28)29)22(21(19)30)34-17-9-7-15(8-10-17)24(31)33-2/h3-13H,1-2H3