[(2S,3S)-3-methyl-1-(2-morpholin-4-ium-4-ylethylamino)-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-3-methyl-1-(2-morpholin-4-ium-4-ylethylamino)-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-2-methyl-1-(2-morpholin-4-ium-4-ylethylcarbamoyl)butyl]ammonium CAS Name: [(2S,3S)-3-methyl-1-[2-(4-morpholin-4-iumyl)ethylamino]-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-3-methyl-1-(2-morpholin-4-ium-4-ylethylamino)-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-2-methyl-1-(2-morpholin-4-ium-4-ylethylcarbamoyl)butyl]ammonium Formula: C12H27N3O2+2 MolecularWeight: 245.36168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC[NH+]1CCOCC1)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NCC[NH+]1CCOCC1)[NH3+]

InChI

InChI=1S/C12H25N3O2/c1-3-10(2)11(13)12(16)14-4-5-15-6-8-17-9-7-15/h10-11H,3-9,13H2,1-2H3,(H,14,16)/p+2/t10-,11-/m0/s1