(2S)-2-methyl-3-(4-methylsulfonylpiperazin-1-yl)sulfonyl-propanoic acid

Systemtic Name: (2S)-2-methyl-3-(4-methylsulfonylpiperazin-1-yl)sulfonyl-propanoic acid Openeye Name: (2S)-2-methyl-3-(4-methylsulfonylpiperazin-1-yl)sulfonyl-propanoic acid CAS Name: (2S)-2-methyl-3-[(4-methylsulfonyl-1-piperazinyl)sulfonyl]propanoic acid IUPAC Name: (2S)-2-methyl-3-(4-methylsulfonylpiperazin-1-yl)sulfonylpropanoic acid Traditional Name: (2S)-3-(4-mesylpiperazino)sulfonyl-2-methyl-propionic acid Formula: C9H18N2O6S2 MolecularWeight: 314.37902

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)N1CCN(CC1)S(=O)(=O)C)C(=O)O

Isomeric SMILES

C[C@H](CS(=O)(=O)N1CCN(CC1)S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C9H18N2O6S2/c1-8(9(12)13)7-19(16,17)11-5-3-10(4-6-11)18(2,14)15/h8H,3-7H2,1-2H3,(H,12,13)/t8-/m1/s1