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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H27N3O/c1-6-11(7-2)14-12(16)10(3)13-8-9-15(4)5/h10-11,13H,6-9H2,1-5H3,(H,14,16)/p+1/t10-/m0/s1