(3-phenoxyphenyl)methyl 2-[4-(trifluoromethylsulfinyl)phenyl]pentanoate

Systemtic Name: (3-phenoxyphenyl)methyl 2-[4-(trifluoromethylsulfinyl)phenyl]pentanoate Openeye Name: (3-phenoxyphenyl)methyl 2-[4-(trifluoromethylsulfinyl)phenyl]pentanoate CAS Name: 2-[4-(trifluoromethylsulfinyl)phenyl]pentanoic acid (3-phenoxyphenyl)methyl ester IUPAC Name: (3-phenoxyphenyl)methyl 2-[4-(trifluoromethylsulfinyl)phenyl]pentanoate Traditional Name: 2-[4-(trifluoromethylsulfinyl)phenyl]valeric acid (3-phenoxybenzyl) ester Formula: C25H23F3O4S MolecularWeight: 476.50793

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)S(=O)C(F)(F)F)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCC(C1=CC=C(C=C1)S(=O)C(F)(F)F)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H23F3O4S/c1-2-7-23(19-12-14-22(15-13-19)33(30)25(26,27)28)24(29)31-17-18-8-6-11-21(16-18)32-20-9-4-3-5-10-20/h3-6,8-16,23H,2,7,17H2,1H3