3-[[(2S)-2-ethylhexanoyl]-methyl-amino]propylazanium

Systemtic Name: 3-[[(2S)-2-ethylhexanoyl]-methyl-amino]propylazanium Openeye Name: 3-[[(2S)-2-ethylhexanoyl]-methyl-amino]propylammonium CAS Name: 3-[[(2S)-2-ethyl-1-oxohexyl]-methylamino]propylammonium IUPAC Name: 3-[[(2S)-2-ethylhexanoyl]-methylamino]propylazanium Traditional Name: 3-[[(2S)-2-ethylhexanoyl]-methyl-amino]propylammonium Formula: C12H27N2O+ MolecularWeight: 215.35558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N(C)CCC[NH3+]

Isomeric SMILES

CCCC[C@H](CC)C(=O)N(C)CCC[NH3+]

InChI

InChI=1S/C12H26N2O/c1-4-6-8-11(5-2)12(15)14(3)10-7-9-13/h11H,4-10,13H2,1-3H3/p+1/t11-/m0/s1