O1'-tert-butyl O1-ethyl piperazin-1-ium-1,1-dicarboxylate

Systemtic Name: O1'-tert-butyl O1-ethyl piperazin-1-ium-1,1-dicarboxylate Openeye Name: O1'-tert-butyl O1-ethyl piperazin-1-ium-1,1-dicarboxylate CAS Name: piperazin-1-ium-1,1-dicarboxylic acid O1'-tert-butyl ester O1-ethyl ester IUPAC Name: 1-O'-tert-butyl 1-O-ethyl piperazin-1-ium-1,1-dicarboxylate Traditional Name: piperazin-1-ium-1,1-dicarboxylic acid O1'-tert-butyl ester O1-ethyl ester Formula: C12H23N2O4+ MolecularWeight: 259.32202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)[N+]1(CCNCC1)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[N+]1(CCNCC1)C(=O)OC(C)(C)C

InChI

InChI=1S/C12H23N2O4/c1-5-17-10(15)14(8-6-13-7-9-14)11(16)18-12(2,3)4/h13H,5-9H2,1-4H3/q+1