(3R)-4-(2,2-dimethylpropyl)-3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-2-one

Systemtic Name: (3R)-4-(2,2-dimethylpropyl)-3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-2-one Openeye Name: (3R)-4-(2,2-dimethylpropyl)-3-(2-morpholino-2-oxo-ethyl)piperazin-4-ium-2-one CAS Name: (3R)-4-(2,2-dimethylpropyl)-3-[2-(4-morpholinyl)-2-oxoethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-4-(2,2-dimethylpropyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-4-ium-2-one Traditional Name: (3R)-3-(2-keto-2-morpholino-ethyl)-4-neopentyl-piperazin-4-ium-2-one Formula: C15H28N3O3+ MolecularWeight: 298.40112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[NH+]1CCNC(=O)C1CC(=O)N2CCOCC2

Isomeric SMILES

CC(C)(C)C[NH+]1CCNC(=O)[C@H]1CC(=O)N2CCOCC2

InChI

InChI=1S/C15H27N3O3/c1-15(2,3)11-18-5-4-16-14(20)12(18)10-13(19)17-6-8-21-9-7-17/h12H,4-11H2,1-3H3,(H,16,20)/p+1/t12-/m1/s1