2-[[(2S)-1-(butylamino)-1-oxidanylidene-propan-2-yl]amino]ethyl-diethyl-azanium

Systemtic Name: 2-[[(2S)-1-(butylamino)-1-oxidanylidene-propan-2-yl]amino]ethyl-diethyl-azanium Openeye Name: 2-[[(1S)-2-(butylamino)-1-methyl-2-oxo-ethyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[(2S)-1-(butylamino)-1-oxopropan-2-yl]amino]ethyl-diethylammonium IUPAC Name: 2-[[(2S)-1-(butylamino)-1-oxopropan-2-yl]amino]ethyl-diethylazanium Traditional Name: 2-[[(1S)-2-(butylamino)-2-keto-1-methyl-ethyl]amino]ethyl-diethyl-ammonium Formula: C13H30N3O+ MolecularWeight: 244.3968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)NCC[NH+](CC)CC

Isomeric SMILES

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

InChI

InChI=1S/C13H29N3O/c1-5-8-9-15-13(17)12(4)14-10-11-16(6-2)7-3/h12,14H,5-11H2,1-4H3,(H,15,17)/p+1/t12-/m0/s1