3-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]sulfonylpropanoic acid

Systemtic Name: 3-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]sulfonylpropanoic acid Openeye Name: 3-(4-tert-butoxycarbonylpiperazin-1-yl)sulfonylpropanoic acid CAS Name: 3-[[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]sulfonyl]propanoic acid IUPAC Name: 3-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]sulfonylpropanoic acid Traditional Name: 3-(4-tert-butoxycarbonylpiperazino)sulfonylpropionic acid Formula: C12H22N2O6S MolecularWeight: 322.37788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)CCC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)CCC(=O)O

InChI

InChI=1S/C12H22N2O6S/c1-12(2,3)20-11(17)13-5-7-14(8-6-13)21(18,19)9-4-10(15)16/h4-9H2,1-3H3,(H,15,16)