[(2S)-1-oxidanylidene-1-[[(2S)-pentan-2-yl]amino]propan-2-yl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: [(2S)-1-oxidanylidene-1-[[(2S)-pentan-2-yl]amino]propan-2-yl]-(pyridin-2-ylmethyl)azanium Openeye Name: [(1S)-1-methyl-2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethyl]-(2-pyridylmethyl)ammonium CAS Name: [(2S)-1-oxo-1-[[(2S)-pentan-2-yl]amino]propan-2-yl]-(2-pyridinylmethyl)ammonium IUPAC Name: [(2S)-1-oxo-1-[[(2S)-pentan-2-yl]amino]propan-2-yl]-(pyridin-2-ylmethyl)azanium Traditional Name: [(1S)-2-keto-1-methyl-2-[[(1S)-1-methylbutyl]amino]ethyl]-(2-pyridylmethyl)ammonium Formula: C14H24N3O+ MolecularWeight: 250.35986

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C(C)[NH2+]CC1=CC=CC=N1

Isomeric SMILES

CCC[C@H](C)NC(=O)[C@H](C)[NH2+]CC1=CC=CC=N1

InChI

InChI=1S/C14H23N3O/c1-4-7-11(2)17-14(18)12(3)16-10-13-8-5-6-9-15-13/h5-6,8-9,11-12,16H,4,7,10H2,1-3H3,(H,17,18)/p+1/t11-,12-/m0/s1