tert-butyl 2-[3,5-bis(fluoranyl)-2-nitro-phenyl]-2-(4-methylphenyl)sulfonyl-ethanoate

Systemtic Name: tert-butyl 2-[3,5-bis(fluoranyl)-2-nitro-phenyl]-2-(4-methylphenyl)sulfonyl-ethanoate Openeye Name: tert-butyl 2-(3,5-difluoro-2-nitro-phenyl)-2-(p-tolylsulfonyl)acetate CAS Name: 2-(3,5-difluoro-2-nitrophenyl)-2-(4-methylphenyl)sulfonylacetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3,5-difluoro-2-nitrophenyl)-2-(4-methylphenyl)sulfonylacetate Traditional Name: 2-(3,5-difluoro-2-nitro-phenyl)-2-tosyl-acetic acid tert-butyl ester Formula: C19H19F2NO6S MolecularWeight: 427.419066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C2=CC(=CC(=C2[N+](=O)[O-])F)F)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C2=CC(=CC(=C2[N+](=O)[O-])F)F)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H19F2NO6S/c1-11-5-7-13(8-6-11)29(26,27)17(18(23)28-19(2,3)4)14-9-12(20)10-15(21)16(14)22(24)25/h5-10,17H,1-4H3