[1,1,1-tris(fluoranyl)-5-(4-phenylmethoxyphenyl)pentan-2-yl] propanoate

Systemtic Name: [1,1,1-tris(fluoranyl)-5-(4-phenylmethoxyphenyl)pentan-2-yl] propanoate Openeye Name: [4-(4-benzyloxyphenyl)-1-(trifluoromethyl)butyl] propanoate CAS Name: propanoic acid [1,1,1-trifluoro-5-(4-phenylmethoxyphenyl)pentan-2-yl] ester IUPAC Name: [1,1,1-trifluoro-5-(4-phenylmethoxyphenyl)pentan-2-yl] propanoate Traditional Name: propionic acid [4-(4-benzoxyphenyl)-1-(trifluoromethyl)butyl] ester Formula: C21H23F3O3 MolecularWeight: 380.40073

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(CCCC1=CC=C(C=C1)OCC2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

CCC(=O)OC(CCCC1=CC=C(C=C1)OCC2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C21H23F3O3/c1-2-20(25)27-19(21(22,23)24)10-6-9-16-11-13-18(14-12-16)26-15-17-7-4-3-5-8-17/h3-5,7-8,11-14,19H,2,6,9-10,15H2,1H3