1-morpholin-4-ium-4-ylpropan-2-yl 3,4,5-trimethoxybenzoate chloride

Systemtic Name: 1-morpholin-4-ium-4-ylpropan-2-yl 3,4,5-trimethoxybenzoate chloride Openeye Name: (1-methyl-2-morpholin-4-ium-4-yl-ethyl) 3,4,5-trimethoxybenzoate chloride CAS Name: 3,4,5-trimethoxybenzoic acid 1-(4-morpholin-4-iumyl)propan-2-yl ester chloride IUPAC Name: 1-morpholin-4-ium-4-ylpropan-2-yl 3,4,5-trimethoxybenzoate chloride Traditional Name: 3,4,5-trimethoxybenzoic acid (1-methyl-2-morpholin-4-ium-4-yl-ethyl) ester chloride Formula: C17H26ClNO6 MolecularWeight: 375.84444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO6.ClH/c1-12(11-18-5-7-23-8-6-18)24-17(19)13-9-14(20-2)16(22-4)15(10-13)21-3;/h9-10,12H,5-8,11H2,1-4H3;1H