1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-(5-fluoranyl-2-nitro-phenoxy)ethanone

Systemtic Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-(5-fluoranyl-2-nitro-phenoxy)ethanone Openeye Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-(5-fluoro-2-nitro-phenoxy)ethanone CAS Name: 1-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-(5-fluoro-2-nitrophenoxy)ethanone IUPAC Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-(5-fluoro-2-nitrophenoxy)ethanone Traditional Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]-2-(5-fluoro-2-nitro-phenoxy)ethanone Formula: C20H22FN3O8S MolecularWeight: 483.467383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H22FN3O8S/c1-30-15-4-6-17(31-2)19(12-15)33(28,29)23-9-7-22(8-10-23)20(25)13-32-18-11-14(21)3-5-16(18)24(26)27/h3-6,11-12H,7-10,13H2,1-2H3