2,2-bis(fluoranyl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-2-phenyl-ethanamide

Systemtic Name: 2,2-bis(fluoranyl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-2-phenyl-ethanamide Openeye Name: 2,2-difluoro-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-2-phenyl-acetamide CAS Name: 2,2-difluoro-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-phenylacetamide IUPAC Name: 2,2-difluoro-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-phenylacetamide Traditional Name: 2,2-difluoro-N-[2-(4-mesyl-2-nitro-anilino)ethyl]-2-phenyl-acetamide Formula: C17H17F2N3O5S MolecularWeight: 413.395786

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C(C2=CC=CC=C2)(F)F)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C(C2=CC=CC=C2)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H17F2N3O5S/c1-28(26,27)13-7-8-14(15(11-13)22(24)25)20-9-10-21-16(23)17(18,19)12-5-3-2-4-6-12/h2-8,11,20H,9-10H2,1H3,(H,21,23)