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

Systemtic Name: tert-butyl 4-(2-azanyl-2-oxidanylidene-ethyl)piperazin-4-ium-1-carboxylate Openeye Name: tert-butyl 4-(2-amino-2-oxo-ethyl)piperazin-4-ium-1-carboxylate CAS Name: 4-(2-amino-2-oxoethyl)-1-piperazin-4-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-amino-2-oxoethyl)piperazin-4-ium-1-carboxylate Traditional Name: 4-(2-amino-2-keto-ethyl)piperazin-4-ium-1-carboxylic acid tert-butyl ester Formula: C11H22N3O3+ MolecularWeight: 244.31068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC[NH+](CC1)CC(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[NH+](CC1)CC(=O)N

InChI

InChI=1S/C11H21N3O3/c1-11(2,3)17-10(16)14-6-4-13(5-7-14)8-9(12)15/h4-8H2,1-3H3,(H2,12,15)/p+1