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

Systemtic Name: 2-(3-chloranyl-4-fluoranyl-phenoxy)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(3-chloro-4-fluoro-phenoxy)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(3-chloro-4-fluorophenoxy)-1-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(3-chloro-4-fluorophenoxy)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(3-chloro-4-fluoro-phenoxy)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]ethanone Formula: C20H22ClFN2O6S MolecularWeight: 472.914883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC(=C(C=C3)F)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC(=C(C=C3)F)Cl)OC

InChI

InChI=1S/C20H22ClFN2O6S/c1-28-18-6-4-15(12-19(18)29-2)31(26,27)24-9-7-23(8-10-24)20(25)13-30-14-3-5-17(22)16(21)11-14/h3-6,11-12H,7-10,13H2,1-2H3