dimethyl-[3-[[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl]amino]propyl]azanium

Systemtic Name: dimethyl-[3-[[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl]amino]propyl]azanium Openeye Name: 3-[[(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethyl]amino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[[(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl]amino]propyl]azanium Traditional Name: 3-[[(1S)-2-(isobutylamino)-2-keto-1-methyl-ethyl]amino]propyl-dimethyl-ammonium Formula: C12H28N3O+ MolecularWeight: 230.37022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)NCCC[NH+](C)C

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)NCCC[NH+](C)C

InChI

InChI=1S/C12H27N3O/c1-10(2)9-14-12(16)11(3)13-7-6-8-15(4)5/h10-11,13H,6-9H2,1-5H3,(H,14,16)/p+1/t11-/m0/s1