methyl (4S)-4-[4-methyl-2-(trifluoromethylsulfonyloxy)phenyl]pentanoate

Systemtic Name: methyl (4S)-4-[4-methyl-2-(trifluoromethylsulfonyloxy)phenyl]pentanoate Openeye Name: methyl (4S)-4-[4-methyl-2-(trifluoromethylsulfonyloxy)phenyl]pentanoate CAS Name: (4S)-4-[4-methyl-2-(trifluoromethylsulfonyloxy)phenyl]pentanoic acid methyl ester IUPAC Name: methyl (4S)-4-[4-methyl-2-(trifluoromethylsulfonyloxy)phenyl]pentanoate Traditional Name: (4S)-4-(4-methyl-2-triflyloxy-phenyl)valeric acid methyl ester Formula: C14H17F3O5S MolecularWeight: 354.34199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)CCC(=O)OC)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)[C@@H](C)CCC(=O)OC)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C14H17F3O5S/c1-9-4-6-11(10(2)5-7-13(18)21-3)12(8-9)22-23(19,20)14(15,16)17/h4,6,8,10H,5,7H2,1-3H3/t10-/m0/s1