2-(2-chloranyl-4-nitro-phenoxy)-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(2-chloranyl-4-nitro-phenoxy)-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(2-chloro-4-nitro-phenoxy)-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(2-chloro-4-nitrophenoxy)-1-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(2-chloro-4-nitrophenoxy)-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(2-chloro-4-nitro-phenoxy)-1-[4-(3-fluorophenyl)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)[N+](=O)[O-])Cl)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

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

InChI

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