(2,2-dimethyl-3-morpholin-4-ium-4-yl-propyl) benzoate chloride

Systemtic Name: (2,2-dimethyl-3-morpholin-4-ium-4-yl-propyl) benzoate chloride Openeye Name: (2,2-dimethyl-3-morpholin-4-ium-4-yl-propyl) benzoate chloride CAS Name: benzoic acid [2,2-dimethyl-3-(4-morpholin-4-iumyl)propyl] ester chloride IUPAC Name: (2,2-dimethyl-3-morpholin-4-ium-4-ylpropyl) benzoate chloride Traditional Name: benzoic acid (2,2-dimethyl-3-morpholin-4-ium-4-yl-propyl) ester chloride Formula: C16H24ClNO3 MolecularWeight: 313.81966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH+]1CCOCC1)COC(=O)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC(C)(C[NH+]1CCOCC1)COC(=O)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C16H23NO3.ClH/c1-16(2,12-17-8-10-19-11-9-17)13-20-15(18)14-6-4-3-5-7-14;/h3-7H,8-13H2,1-2H3;1H