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

Systemtic Name: [(2S)-1-oxidanylidene-1-[[(2S)-pentan-2-yl]amino]propan-2-yl]-(2-pyridin-2-ylethyl)azanium Openeye Name: [(1S)-1-methyl-2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethyl]-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(2S)-1-oxo-1-[[(2S)-pentan-2-yl]amino]propan-2-yl]-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(2S)-1-oxo-1-[[(2S)-pentan-2-yl]amino]propan-2-yl]-(2-pyridin-2-ylethyl)azanium Traditional Name: [(1S)-2-keto-1-methyl-2-[[(1S)-1-methylbutyl]amino]ethyl]-[2-(2-pyridyl)ethyl]ammonium Formula: C15H26N3O+ MolecularWeight: 264.38644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3O/c1-4-7-12(2)18-15(19)13(3)16-11-9-14-8-5-6-10-17-14/h5-6,8,10,12-13,16H,4,7,9,11H2,1-3H3,(H,18,19)/p+1/t12-,13-/m0/s1