N'-(4-fluoranyl-3-nitro-phenyl)-N-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]ethanediamide

Systemtic Name: N'-(4-fluoranyl-3-nitro-phenyl)-N-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]ethanediamide Openeye Name: N'-(4-fluoro-3-nitro-phenyl)-N-[2-[1-(p-tolylsulfonyl)-2-piperidyl]ethyl]oxamide CAS Name: N'-(4-fluoro-3-nitrophenyl)-N-[2-[1-(4-methylphenyl)sulfonyl-2-piperidinyl]ethyl]oxamide IUPAC Name: N'-(4-fluoro-3-nitrophenyl)-N-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]oxamide Traditional Name: N'-(4-fluoro-3-nitro-phenyl)-N-[2-(1-tosyl-2-piperidyl)ethyl]oxamide Formula: C22H25FN4O6S MolecularWeight: 492.520503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2CCNC(=O)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2CCNC(=O)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C22H25FN4O6S/c1-15-5-8-18(9-6-15)34(32,33)26-13-3-2-4-17(26)11-12-24-21(28)22(29)25-16-7-10-19(23)20(14-16)27(30)31/h5-10,14,17H,2-4,11-13H2,1H3,(H,24,28)(H,25,29)