3-[methyl-[(2S)-1-oxidanylidene-1-(pentylamino)propan-2-yl]amino]propylazanium

Systemtic Name: 3-[methyl-[(2S)-1-oxidanylidene-1-(pentylamino)propan-2-yl]amino]propylazanium Openeye Name: 3-[methyl-[(1S)-1-methyl-2-oxo-2-(pentylamino)ethyl]amino]propylammonium CAS Name: 3-[methyl-[(2S)-1-oxo-1-(pentylamino)propan-2-yl]amino]propylammonium IUPAC Name: 3-[methyl-[(2S)-1-oxo-1-(pentylamino)propan-2-yl]amino]propylazanium Traditional Name: 3-[[(1S)-2-(amylamino)-2-keto-1-methyl-ethyl]-methyl-amino]propylammonium Formula: C12H28N3O+ MolecularWeight: 230.37022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(C)N(C)CCC[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C12H27N3O/c1-4-5-6-9-14-12(16)11(2)15(3)10-7-8-13/h11H,4-10,13H2,1-3H3,(H,14,16)/p+1/t11-/m0/s1