ethyl 7-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]sulfonyl-heptanoate

Systemtic Name: ethyl 7-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]sulfonyl-heptanoate Openeye Name: ethyl 7-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]sulfonyl-heptanoate CAS Name: 7-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]sulfonylheptanoic acid ethyl ester IUPAC Name: ethyl 7-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]sulfonylheptanoate Traditional Name: 7-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenyl]sulfonyl-enanthic acid ethyl ester Formula: C22H24ClF3O4S MolecularWeight: 476.93677

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCC1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C(CCCCCC1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C22H24ClF3O4S/c1-2-30-21(27)20(10-5-3-4-7-16-11-13-18(23)14-12-16)31(28,29)19-9-6-8-17(15-19)22(24,25)26/h6,8-9,11-15,20H,2-5,7,10H2,1H3