N-(4-fluoranyl-3-nitro-phenyl)-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-1-(4-isopropylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(4-fluoro-3-nitrophenyl)-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-1-p-cumenylsulfonyl-isonipecotamide Formula: C21H24FN3O5S MolecularWeight: 449.495763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C21H24FN3O5S/c1-14(2)15-3-6-18(7-4-15)31(29,30)24-11-9-16(10-12-24)21(26)23-17-5-8-19(22)20(13-17)25(27)28/h3-8,13-14,16H,9-12H2,1-2H3,(H,23,26)