[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]-(2-pyridin-2-ylethyl)azanium Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl]-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl]-(2-pyridin-2-ylethyl)azanium Traditional Name: [(1S)-2-keto-1-methyl-2-(propylamino)ethyl]-[2-(2-pyridyl)ethyl]ammonium Formula: C13H22N3O+ MolecularWeight: 236.33328

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)[NH2+]CCC1=CC=CC=N1

Isomeric SMILES

CCCNC(=O)[C@H](C)[NH2+]CCC1=CC=CC=N1

InChI

InChI=1S/C13H21N3O/c1-3-8-16-13(17)11(2)14-10-7-12-6-4-5-9-15-12/h4-6,9,11,14H,3,7-8,10H2,1-2H3,(H,16,17)/p+1/t11-/m0/s1