2-(2-chloranyl-4-fluoranyl-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(2-chloranyl-4-fluoranyl-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(2-chloro-4-fluoro-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(2-chloro-4-fluorophenoxy)-1-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(2-chloro-4-fluorophenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(2-chloro-4-fluoro-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazino]ethanone Formula: C18H17ClFN3O6S MolecularWeight: 457.860483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)F)Cl)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)F)Cl)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClFN3O6S/c19-16-10-13(20)4-5-17(16)29-12-18(24)21-6-8-22(9-7-21)30(27,28)15-3-1-2-14(11-15)23(25)26/h1-5,10-11H,6-9,12H2