tert-butyl 2-[[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-tert-butyl-amino]ethanoate

Systemtic Name: tert-butyl 2-[[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-tert-butyl-amino]ethanoate Openeye Name: tert-butyl 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-tert-butyl-amino]acetate CAS Name: 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-tert-butylamino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-tert-butylamino]acetate Traditional Name: 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-tert-butyl-amino]acetic acid tert-butyl ester Formula: C17H23BrF3NO5S MolecularWeight: 490.33243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC(=O)OC(C)(C)C)S(=O)(=O)C1=C(C=C(C=C1)Br)OC(F)(F)F

Isomeric SMILES

CC(C)(C)N(CC(=O)OC(C)(C)C)S(=O)(=O)C1=C(C=C(C=C1)Br)OC(F)(F)F

InChI

InChI=1S/C17H23BrF3NO5S/c1-15(2,3)22(10-14(23)27-16(4,5)6)28(24,25)13-8-7-11(18)9-12(13)26-17(19,20)21/h7-9H,10H2,1-6H3