dimethyl-[(2S)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]azanium

Systemtic Name: dimethyl-[(2S)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]azanium Openeye Name: dimethyl-[(1S)-1-methyl-2-oxo-2-piperazin-1-yl-ethyl]ammonium CAS Name: dimethyl-[(2S)-1-oxo-1-(1-piperazinyl)propan-2-yl]ammonium IUPAC Name: dimethyl-[(2S)-1-oxo-1-piperazin-1-ylpropan-2-yl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-piperazino-ethyl]-dimethyl-ammonium Formula: C9H20N3O+ MolecularWeight: 186.2746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNCC1)[NH+](C)C

Isomeric SMILES

C[C@@H](C(=O)N1CCNCC1)[NH+](C)C

InChI

InChI=1S/C9H19N3O/c1-8(11(2)3)9(13)12-6-4-10-5-7-12/h8,10H,4-7H2,1-3H3/p+1/t8-/m0/s1