[3-(2-chloranylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-hexoxybenzoate

Systemtic Name: [3-(2-chloranylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-hexoxybenzoate Openeye Name: [3-(2-chlorophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-hexoxybenzoate CAS Name: 4-hexoxybenzoic acid [3-(2-chlorophenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-chlorophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-hexoxybenzoate Traditional Name: 4-hexoxybenzoic acid [3-(2-chlorophenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C29H24ClF3O6 MolecularWeight: 560.94547

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4Cl

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4Cl

InChI

InChI=1S/C29H24ClF3O6/c1-2-3-4-7-16-36-19-12-10-18(11-13-19)28(35)37-20-14-15-21-24(17-20)39-27(29(31,32)33)26(25(21)34)38-23-9-6-5-8-22(23)30/h5-6,8-15,17H,2-4,7,16H2,1H3