[(2S,3S)-3-methyl-1-oxidanylidene-1-(2-pyridin-3-ylethylamino)pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-3-methyl-1-oxidanylidene-1-(2-pyridin-3-ylethylamino)pentan-2-yl]azanium Openeye Name: [(1S,2S)-2-methyl-1-[2-(3-pyridyl)ethylcarbamoyl]butyl]ammonium CAS Name: [(2S,3S)-3-methyl-1-oxo-1-[2-(3-pyridinyl)ethylamino]pentan-2-yl]ammonium IUPAC Name: [(2S,3S)-3-methyl-1-oxo-1-(2-pyridin-3-ylethylamino)pentan-2-yl]azanium Traditional Name: [(1S,2S)-2-methyl-1-[2-(3-pyridyl)ethylcarbamoyl]butyl]ammonium Formula: C13H22N3O+ MolecularWeight: 236.33328

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCCC1=CN=CC=C1)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NCCC1=CN=CC=C1)[NH3+]

InChI

InChI=1S/C13H21N3O/c1-3-10(2)12(14)13(17)16-8-6-11-5-4-7-15-9-11/h4-5,7,9-10,12H,3,6,8,14H2,1-2H3,(H,16,17)/p+1/t10-,12-/m0/s1