1-(3,4-dimethoxyphenyl)sulfonyl-4-methyl-piperazin-4-ium

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-methyl-piperazin-4-ium Openeye Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-methyl-piperazin-4-ium CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-methylpiperazin-4-ium IUPAC Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-methylpiperazin-4-ium Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-methyl-piperazin-4-ium Formula: C13H21N2O4S+ MolecularWeight: 301.38184

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C13H20N2O4S/c1-14-6-8-15(9-7-14)20(16,17)11-4-5-12(18-2)13(10-11)19-3/h4-5,10H,6-9H2,1-3H3/p+1