(2S)-4-ethanoyl-N-[(3S)-2-oxidanylidenepiperidin-3-yl]piperazin-1-ium-2-carboxamide

Systemtic Name: (2S)-4-ethanoyl-N-[(3S)-2-oxidanylidenepiperidin-3-yl]piperazin-1-ium-2-carboxamide Openeye Name: (2S)-4-acetyl-N-[(3S)-2-oxo-3-piperidyl]piperazin-1-ium-2-carboxamide CAS Name: (2S)-4-acetyl-N-[(3S)-2-oxo-3-piperidinyl]-2-piperazin-1-iumcarboxamide IUPAC Name: (2S)-4-acetyl-N-[(3S)-2-oxopiperidin-3-yl]piperazin-1-ium-2-carboxamide Traditional Name: (2S)-4-acetyl-N-[(3S)-2-keto-3-piperidyl]piperazin-1-ium-2-carboxamide Formula: C12H21N4O3+ MolecularWeight: 269.32014

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH2+]C(C1)C(=O)NC2CCCNC2=O

Isomeric SMILES

CC(=O)N1CC[NH2+][C@@H](C1)C(=O)N[C@H]2CCCNC2=O

InChI

InChI=1S/C12H20N4O3/c1-8(17)16-6-5-13-10(7-16)12(19)15-9-3-2-4-14-11(9)18/h9-10,13H,2-7H2,1H3,(H,14,18)(H,15,19)/p+1/t9-,10-/m0/s1