3-(1,3-benzodioxol-5-yl)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-(4-methylsulfonyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-(4-mesylpiperazino)propan-1-one Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H20N2O5S/c1-23(19,20)17-8-6-16(7-9-17)15(18)5-3-12-2-4-13-14(10-12)22-11-21-13/h2,4,10H,3,5-9,11H2,1H3