tert-butyl 4-(2-ethoxy-2-oxidanylidene-ethyl)piperazin-4-ium-1-carboxylate

Systemtic Name: tert-butyl 4-(2-ethoxy-2-oxidanylidene-ethyl)piperazin-4-ium-1-carboxylate Openeye Name: tert-butyl 4-(2-ethoxy-2-oxo-ethyl)piperazin-4-ium-1-carboxylate CAS Name: 4-(2-ethoxy-2-oxoethyl)-1-piperazin-4-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-ethoxy-2-oxoethyl)piperazin-4-ium-1-carboxylate Traditional Name: 4-(2-ethoxy-2-keto-ethyl)piperazin-4-ium-1-carboxylic acid tert-butyl ester Formula: C13H25N2O4+ MolecularWeight: 273.3486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[NH+]1CCN(CC1)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C[NH+]1CCN(CC1)C(=O)OC(C)(C)C

InChI

InChI=1S/C13H24N2O4/c1-5-18-11(16)10-14-6-8-15(9-7-14)12(17)19-13(2,3)4/h5-10H2,1-4H3/p+1