[1,1,1-tris(fluoranyl)-3-methoxy-propan-2-yl] 4-(4-hexoxyphenyl)benzoate

Systemtic Name: [1,1,1-tris(fluoranyl)-3-methoxy-propan-2-yl] 4-(4-hexoxyphenyl)benzoate Openeye Name: [2,2,2-trifluoro-1-(methoxymethyl)ethyl] 4-(4-hexoxyphenyl)benzoate CAS Name: 4-(4-hexoxyphenyl)benzoic acid (1,1,1-trifluoro-3-methoxypropan-2-yl) ester IUPAC Name: (1,1,1-trifluoro-3-methoxypropan-2-yl) 4-(4-hexoxyphenyl)benzoate Traditional Name: 4-(4-hexoxyphenyl)benzoic acid [2,2,2-trifluoro-1-(methoxymethyl)ethyl] ester Formula: C23H27F3O4 MolecularWeight: 424.45329

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(COC)C(F)(F)F

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(COC)C(F)(F)F

InChI

InChI=1S/C23H27F3O4/c1-3-4-5-6-15-29-20-13-11-18(12-14-20)17-7-9-19(10-8-17)22(27)30-21(16-28-2)23(24,25)26/h7-14,21H,3-6,15-16H2,1-2H3