2-(1,3-benzodioxol-5-yl)-1-[2-[2-(4-methylphenyl)sulfonylethanoyl]pyrazolidin-1-yl]ethanone

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-[2-[2-(4-methylphenyl)sulfonylethanoyl]pyrazolidin-1-yl]ethanone Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-[2-[2-(p-tolylsulfonyl)acetyl]pyrazolidin-1-yl]ethanone CAS Name: 2-(1,3-benzodioxol-5-yl)-1-[2-[2-(4-methylphenyl)sulfonyl-1-oxoethyl]-1-pyrazolidinyl]ethanone IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-[2-[2-(4-methylphenyl)sulfonylacetyl]pyrazolidin-1-yl]ethanone Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2-tosylacetyl)pyrazolidin-1-yl]ethanone Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N2CCCN2C(=O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N2CCCN2C(=O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N2O6S/c1-15-3-6-17(7-4-15)30(26,27)13-21(25)23-10-2-9-22(23)20(24)12-16-5-8-18-19(11-16)29-14-28-18/h3-8,11H,2,9-10,12-14H2,1H3