2-(5-fluoranyl-2-nitro-phenoxy)-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(5-fluoranyl-2-nitro-phenoxy)-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(5-fluoro-2-nitro-phenoxy)-N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(5-fluoro-2-nitrophenoxy)-N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(5-fluoro-2-nitrophenoxy)-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(5-fluoro-2-nitro-phenoxy)-N-(2-methyl-5-piperidinosulfonyl-phenyl)acetamide Formula: C20H22FN3O6S MolecularWeight: 451.468583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H22FN3O6S/c1-14-5-7-16(31(28,29)23-9-3-2-4-10-23)12-17(14)22-20(25)13-30-19-11-15(21)6-8-18(19)24(26)27/h5-8,11-12H,2-4,9-10,13H2,1H3,(H,22,25)