methyl 2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanoate

Systemtic Name: methyl 2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanoate Openeye Name: methyl 2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetate CAS Name: 2-(4-methylsulfonyl-1-piperazin-1-iumyl)acetic acid methyl ester IUPAC Name: methyl 2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetate Traditional Name: 2-(4-mesylpiperazin-1-ium-1-yl)acetic acid methyl ester Formula: C8H17N2O4S+ MolecularWeight: 237.29658

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C

Isomeric SMILES

COC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C

InChI

InChI=1S/C8H16N2O4S/c1-14-8(11)7-9-3-5-10(6-4-9)15(2,12)13/h3-7H2,1-2H3/p+1