[4-(2-azanylethyl)-2,3-bis(oxidanylidene)piperazin-1-yl] 3,3-dimethylbutanoate

Systemtic Name: [4-(2-azanylethyl)-2,3-bis(oxidanylidene)piperazin-1-yl] 3,3-dimethylbutanoate Openeye Name: [4-(2-aminoethyl)-2,3-dioxo-piperazin-1-yl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [4-(2-aminoethyl)-2,3-dioxo-1-piperazinyl] ester IUPAC Name: [4-(2-aminoethyl)-2,3-dioxopiperazin-1-yl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [4-(2-aminoethyl)-2,3-diketo-piperazino] ester Formula: C12H21N3O4 MolecularWeight: 271.31284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)ON1CCN(C(=O)C1=O)CCN

Isomeric SMILES

CC(C)(C)CC(=O)ON1CCN(C(=O)C1=O)CCN

InChI

InChI=1S/C12H21N3O4/c1-12(2,3)8-9(16)19-15-7-6-14(5-4-13)10(17)11(15)18/h4-8,13H2,1-3H3