2-(5-fluoranyl-2-nitro-phenoxy)-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethanone

Systemtic Name: 2-(5-fluoranyl-2-nitro-phenoxy)-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethanone Openeye Name: 2-(5-fluoro-2-nitro-phenoxy)-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethanone CAS Name: 2-(5-fluoro-2-nitrophenoxy)-1-[4-(1-pyrrolidinylsulfonyl)phenyl]ethanone IUPAC Name: 2-(5-fluoro-2-nitrophenoxy)-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethanone Traditional Name: 2-(5-fluoro-2-nitro-phenoxy)-1-(4-pyrrolidinosulfonylphenyl)ethanone Formula: C18H17FN2O6S MolecularWeight: 408.400783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H17FN2O6S/c19-14-5-8-16(21(23)24)18(11-14)27-12-17(22)13-3-6-15(7-4-13)28(25,26)20-9-1-2-10-20/h3-8,11H,1-2,9-10,12H2