3-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-ium-1-yl]propanoic acid chloride

Systemtic Name: 3-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-ium-1-yl]propanoic acid chloride Openeye Name: 3-(4-tert-butoxycarbonylpiperazin-1-ium-1-yl)propanoic acid chloride CAS Name: 3-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazin-1-iumyl]propanoic acid chloride IUPAC Name: 3-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-ium-1-yl]propanoic acid chloride Traditional Name: 3-(4-tert-butoxycarbonylpiperazin-1-ium-1-yl)propionic acid chloride Formula: C12H23ClN2O4 MolecularWeight: 294.77502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC[NH+](CC1)CCC(=O)O.[Cl-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[NH+](CC1)CCC(=O)O.[Cl-]

InChI

InChI=1S/C12H22N2O4.ClH/c1-12(2,3)18-11(17)14-8-6-13(7-9-14)5-4-10(15)16;/h4-9H2,1-3H3,(H,15,16);1H