3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(2S)-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(2S)-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-1-methyl-2-morpholino-2-oxo-ethyl]-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ammonium CAS Name: 3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl-[(2S)-1-(4-morpholinyl)-1-oxopropan-2-yl]ammonium IUPAC Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-morpholino-ethyl]-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ammonium Formula: C16H33N3O2+2 MolecularWeight: 299.45212

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCC[NH2+]C(C)C(=O)N2CCOCC2

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCC[NH2+][C@@H](C)C(=O)N2CCOCC2

InChI

InChI=1S/C16H31N3O2/c1-14-6-3-4-8-18(14)9-5-7-17-15(2)16(20)19-10-12-21-13-11-19/h14-15,17H,3-13H2,1-2H3/p+2/t14-,15-/m0/s1