2-(1,3-benzodioxol-5-yloxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(1,3-benzodioxol-5-yloxy)-1-(4-tosylpiperazino)ethanone Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O6S/c1-15-2-5-17(6-3-15)29(24,25)22-10-8-21(9-11-22)20(23)13-26-16-4-7-18-19(12-16)28-14-27-18/h2-7,12H,8-11,13-14H2,1H3