2-morpholin-4-ium-4-ylethyl 3-methoxy-4-oxidanyl-benzoate

Systemtic Name: 2-morpholin-4-ium-4-ylethyl 3-methoxy-4-oxidanyl-benzoate Openeye Name: 2-morpholin-4-ium-4-ylethyl 4-hydroxy-3-methoxy-benzoate CAS Name: 4-hydroxy-3-methoxybenzoic acid 2-(4-morpholin-4-iumyl)ethyl ester IUPAC Name: 2-morpholin-4-ium-4-ylethyl 4-hydroxy-3-methoxybenzoate Traditional Name: 4-hydroxy-3-methoxy-benzoic acid 2-morpholin-4-ium-4-ylethyl ester Formula: C14H20NO5+ MolecularWeight: 282.3123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC[NH+]2CCOCC2)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC[NH+]2CCOCC2)O

InChI

InChI=1S/C14H19NO5/c1-18-13-10-11(2-3-12(13)16)14(17)20-9-6-15-4-7-19-8-5-15/h2-3,10,16H,4-9H2,1H3/p+1