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

Systemtic Name: dimethyl-[3-[[(2S)-1-oxidanylidene-1-(pentan-3-ylamino)propan-2-yl]amino]propyl]azanium Openeye Name: 3-[[(1S)-2-(1-ethylpropylamino)-1-methyl-2-oxo-ethyl]amino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[[(2S)-1-oxo-1-(pentan-3-ylamino)propan-2-yl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[(2S)-1-oxo-1-(pentan-3-ylamino)propan-2-yl]amino]propyl]azanium Traditional Name: 3-[[(1S)-2-(1-ethylpropylamino)-2-keto-1-methyl-ethyl]amino]propyl-dimethyl-ammonium Formula: C13H30N3O+ MolecularWeight: 244.3968

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C(C)NCCC[NH+](C)C

Isomeric SMILES

CCC(CC)NC(=O)[C@H](C)NCCC[NH+](C)C

InChI

InChI=1S/C13H29N3O/c1-6-12(7-2)15-13(17)11(3)14-9-8-10-16(4)5/h11-12,14H,6-10H2,1-5H3,(H,15,17)/p+1/t11-/m0/s1