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

Systemtic Name: 2-(5-fluoranyl-2-nitro-phenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(5-fluoro-2-nitro-phenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-(5-fluoro-2-nitrophenoxy)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(5-fluoro-2-nitrophenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(5-fluoro-2-nitro-phenoxy)-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C18H18FN3O6S MolecularWeight: 423.415423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18FN3O6S/c19-13-3-8-16(22(24)25)17(11-13)28-12-18(23)20-14-4-6-15(7-5-14)29(26,27)21-9-1-2-10-21/h3-8,11H,1-2,9-10,12H2,(H,20,23)