1-morpholin-4-ium-4-ylpropan-2-yl benzoate chloride

Systemtic Name: 1-morpholin-4-ium-4-ylpropan-2-yl benzoate chloride Openeye Name: (1-methyl-2-morpholin-4-ium-4-yl-ethyl) benzoate chloride CAS Name: benzoic acid 1-(4-morpholin-4-iumyl)propan-2-yl ester chloride IUPAC Name: 1-morpholin-4-ium-4-ylpropan-2-yl benzoate chloride Traditional Name: benzoic acid (1-methyl-2-morpholin-4-ium-4-yl-ethyl) ester chloride Formula: C14H20ClNO3 MolecularWeight: 285.7665

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3.ClH/c1-12(11-15-7-9-17-10-8-15)18-14(16)13-5-3-2-4-6-13;/h2-6,12H,7-11H2,1H3;1H