2-morpholin-4-ium-4-ylethyl 3,4-dimethoxybenzoate chloride

Systemtic Name: 2-morpholin-4-ium-4-ylethyl 3,4-dimethoxybenzoate chloride Openeye Name: 2-morpholin-4-ium-4-ylethyl 3,4-dimethoxybenzoate chloride CAS Name: 3,4-dimethoxybenzoic acid 2-(4-morpholin-4-iumyl)ethyl ester chloride IUPAC Name: 2-morpholin-4-ium-4-ylethyl 3,4-dimethoxybenzoate chloride Traditional Name: 3,4-dimethoxybenzoic acid 2-morpholin-4-ium-4-ylethyl ester chloride Formula: C15H22ClNO5 MolecularWeight: 331.79188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC[NH+]2CCOCC2)OC.[Cl-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC[NH+]2CCOCC2)OC.[Cl-]

InChI

InChI=1S/C15H21NO5.ClH/c1-18-13-4-3-12(11-14(13)19-2)15(17)21-10-7-16-5-8-20-9-6-16;/h3-4,11H,5-10H2,1-2H3;1H