[(2S)-1-oxidanylidene-1-[(5-pyrrolidin-1-ylpyridin-2-yl)amino]propan-2-yl]azanium

Systemtic Name: [(2S)-1-oxidanylidene-1-[(5-pyrrolidin-1-ylpyridin-2-yl)amino]propan-2-yl]azanium Openeye Name: [(1S)-1-methyl-2-oxo-2-[(5-pyrrolidin-1-yl-2-pyridyl)amino]ethyl]ammonium CAS Name: [(2S)-1-oxo-1-[[5-(1-pyrrolidinyl)-2-pyridinyl]amino]propan-2-yl]ammonium IUPAC Name: [(2S)-1-oxo-1-[(5-pyrrolidin-1-ylpyridin-2-yl)amino]propan-2-yl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-[(5-pyrrolidino-2-pyridyl)amino]ethyl]ammonium Formula: C12H19N4O+ MolecularWeight: 235.30546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=C(C=C1)N2CCCC2)[NH3+]

Isomeric SMILES

C[C@@H](C(=O)NC1=NC=C(C=C1)N2CCCC2)[NH3+]

InChI

InChI=1S/C12H18N4O/c1-9(13)12(17)15-11-5-4-10(8-14-11)16-6-2-3-7-16/h4-5,8-9H,2-3,6-7,13H2,1H3,(H,14,15,17)/p+1/t9-/m0/s1