dimethyl-morpholin-4-ylcarbonyl-[3-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)oxycarbonylamino]propyl]azanium

Systemtic Name: dimethyl-morpholin-4-ylcarbonyl-[3-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)oxycarbonylamino]propyl]azanium Openeye Name: 3-[(1-benzyl-2-hydroxy-2-oxo-ethoxy)carbonylamino]propyl-dimethyl-(morpholine-4-carbonyl)ammonium CAS Name: 3-[[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)oxy-oxomethyl]amino]propyl-dimethyl-[4-morpholinyl(oxo)methyl]ammonium IUPAC Name: 3-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)oxycarbonylamino]propyl-dimethyl-(morpholine-4-carbonyl)azanium Traditional Name: 3-[(1-benzyl-2-hydroxy-2-keto-ethoxy)carbonylamino]propyl-dimethyl-(morpholine-4-carbonyl)ammonium Formula: C20H30N3O6+ MolecularWeight: 408.4687

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCNC(=O)OC(CC1=CC=CC=C1)C(=O)O)C(=O)N2CCOCC2

Isomeric SMILES

C[N+](C)(CCCNC(=O)OC(CC1=CC=CC=C1)C(=O)O)C(=O)N2CCOCC2

InChI

InChI=1S/C20H29N3O6/c1-23(2,20(27)22-10-13-28-14-11-22)12-6-9-21-19(26)29-17(18(24)25)15-16-7-4-3-5-8-16/h3-5,7-8,17H,6,9-15H2,1-2H3,(H-,21,24,25,26)/p+1