tert-butyl 2-tert-butylsulfanyl-3-(4-chlorophenyl)imino-4,4,4-tris(fluoranyl)butanoate

Systemtic Name: tert-butyl 2-tert-butylsulfanyl-3-(4-chlorophenyl)imino-4,4,4-tris(fluoranyl)butanoate Openeye Name: tert-butyl 2-tert-butylsulfanyl-3-(4-chlorophenyl)imino-4,4,4-trifluoro-butanoate CAS Name: 2-(tert-butylthio)-3-(4-chlorophenyl)imino-4,4,4-trifluorobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-tert-butylsulfanyl-3-(4-chlorophenyl)imino-4,4,4-trifluorobutanoate Traditional Name: 2-(tert-butylthio)-3-(4-chlorophenyl)imino-4,4,4-trifluoro-butyric acid tert-butyl ester Formula: C18H23ClF3NO2S MolecularWeight: 409.89393

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(=NC1=CC=C(C=C1)Cl)C(F)(F)F)SC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(C(=NC1=CC=C(C=C1)Cl)C(F)(F)F)SC(C)(C)C

InChI

InChI=1S/C18H23ClF3NO2S/c1-16(2,3)25-15(24)13(26-17(4,5)6)14(18(20,21)22)23-12-9-7-11(19)8-10-12/h7-10,13H,1-6H3