1-morpholin-4-ium-4-ylpropan-2-yl 3,4-dimethoxybenzoate chloride

Systemtic Name: 1-morpholin-4-ium-4-ylpropan-2-yl 3,4-dimethoxybenzoate chloride Openeye Name: (1-methyl-2-morpholin-4-ium-4-yl-ethyl) 3,4-dimethoxybenzoate chloride CAS Name: 3,4-dimethoxybenzoic acid 1-(4-morpholin-4-iumyl)propan-2-yl ester chloride IUPAC Name: 1-morpholin-4-ium-4-ylpropan-2-yl 3,4-dimethoxybenzoate chloride Traditional Name: 3,4-dimethoxybenzoic acid (1-methyl-2-morpholin-4-ium-4-yl-ethyl) ester chloride Formula: C16H24ClNO5 MolecularWeight: 345.81846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO5.ClH/c1-12(11-17-6-8-21-9-7-17)22-16(18)13-4-5-14(19-2)15(10-13)20-3;/h4-5,10,12H,6-9,11H2,1-3H3;1H