[3-[[(2S)-1-(3-methoxypropylamino)-1-oxidanylidene-propan-2-yl]azaniumyl]-2,2-dimethyl-propyl]-dimethyl-azanium

Systemtic Name: [3-[[(2S)-1-(3-methoxypropylamino)-1-oxidanylidene-propan-2-yl]azaniumyl]-2,2-dimethyl-propyl]-dimethyl-azanium Openeye Name: [3-[[(1S)-2-(3-methoxypropylamino)-1-methyl-2-oxo-ethyl]ammonio]-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-[[(2S)-1-(3-methoxypropylamino)-1-oxopropan-2-yl]ammonio]-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-[[(2S)-1-(3-methoxypropylamino)-1-oxopropan-2-yl]azaniumyl]-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-[[(1S)-2-keto-2-(3-methoxypropylamino)-1-methyl-ethyl]ammonio]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C14H33N3O2+2 MolecularWeight: 275.43072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCOC)[NH2+]CC(C)(C)C[NH+](C)C

Isomeric SMILES

C[C@@H](C(=O)NCCCOC)[NH2+]CC(C)(C)C[NH+](C)C

InChI

InChI=1S/C14H31N3O2/c1-12(13(18)15-8-7-9-19-6)16-10-14(2,3)11-17(4)5/h12,16H,7-11H2,1-6H3,(H,15,18)/p+2/t12-/m0/s1