(3R)-1-[(2S)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[(2S)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[(1S)-1-methyl-2-oxo-2-piperazin-1-yl-ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[(2S)-1-oxo-1-(1-piperazinyl)propan-2-yl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[(2S)-1-oxo-1-piperazin-1-ylpropan-2-yl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[(1S)-2-keto-1-methyl-2-piperazino-ethyl]piperidin-1-ium-3-carboxamide Formula: C13H25N4O2+ MolecularWeight: 269.3632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNCC1)[NH+]2CCCC(C2)C(=O)N

Isomeric SMILES

C[C@@H](C(=O)N1CCNCC1)[NH+]2CCC[C@H](C2)C(=O)N

InChI

InChI=1S/C13H24N4O2/c1-10(13(19)16-7-4-15-5-8-16)17-6-2-3-11(9-17)12(14)18/h10-11,15H,2-9H2,1H3,(H2,14,18)/p+1/t10-,11+/m0/s1