2-(4-bromanylphenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanylphenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(4-bromophenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(4-bromophenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromophenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(4-bromophenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]ethanone Formula: C20H23BrN2O6S MolecularWeight: 499.37542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN2O6S/c1-27-17-7-8-18(28-2)19(13-17)30(25,26)23-11-9-22(10-12-23)20(24)14-29-16-5-3-15(21)4-6-16/h3-8,13H,9-12,14H2,1-2H3