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

Systemtic Name: [(2S)-1-[[(2S)-butan-2-yl]amino]-1-oxidanylidene-propan-2-yl]-(2-pyridin-2-ylethyl)azanium Openeye Name: [(1S)-1-methyl-2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl]-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(2S)-1-[[(2S)-butan-2-yl]amino]-1-oxopropan-2-yl]-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(2S)-1-[[(2S)-butan-2-yl]amino]-1-oxopropan-2-yl]-(2-pyridin-2-ylethyl)azanium Traditional Name: [(1S)-2-keto-1-methyl-2-[[(1S)-1-methylpropyl]amino]ethyl]-[2-(2-pyridyl)ethyl]ammonium Formula: C14H24N3O+ MolecularWeight: 250.35986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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