3-morpholin-4-ium-4-ylpropyl 3,4-bis(oxidanyl)benzoate

Systemtic Name: 3-morpholin-4-ium-4-ylpropyl 3,4-bis(oxidanyl)benzoate Openeye Name: 3-morpholin-4-ium-4-ylpropyl 3,4-dihydroxybenzoate CAS Name: 3,4-dihydroxybenzoic acid 3-(4-morpholin-4-iumyl)propyl ester IUPAC Name: 3-morpholin-4-ium-4-ylpropyl 3,4-dihydroxybenzoate Traditional Name: 3,4-dihydroxybenzoic acid 3-morpholin-4-ium-4-ylpropyl ester Formula: C14H20NO5+ MolecularWeight: 282.3123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCOC(=O)C2=CC(=C(C=C2)O)O

Isomeric SMILES

C1COCC[NH+]1CCCOC(=O)C2=CC(=C(C=C2)O)O

InChI

InChI=1S/C14H19NO5/c16-12-3-2-11(10-13(12)17)14(18)20-7-1-4-15-5-8-19-9-6-15/h2-3,10,16-17H,1,4-9H2/p+1