1-[(3S,4S)-4-azanylheptan-3-yl]-4-ethyl-piperazine-2,3-dione

Systemtic Name: 1-[(3S,4S)-4-azanylheptan-3-yl]-4-ethyl-piperazine-2,3-dione Openeye Name: 1-[(1S,2S)-2-amino-1-ethyl-pentyl]-4-ethyl-piperazine-2,3-dione CAS Name: 1-[(3S,4S)-4-aminoheptan-3-yl]-4-ethylpiperazine-2,3-dione IUPAC Name: 1-[(3S,4S)-4-aminoheptan-3-yl]-4-ethylpiperazine-2,3-dione Traditional Name: 1-[(1S,2S)-2-amino-1-ethyl-pentyl]-4-ethyl-piperazine-2,3-quinone Formula: C13H25N3O2 MolecularWeight: 255.3565

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)N1CCN(C(=O)C1=O)CC)N

Isomeric SMILES

CCC[C@@H]([C@H](CC)N1CCN(C(=O)C1=O)CC)N

InChI

InChI=1S/C13H25N3O2/c1-4-7-10(14)11(5-2)16-9-8-15(6-3)12(17)13(16)18/h10-11H,4-9,14H2,1-3H3/t10-,11-/m0/s1