8-(morpholin-4-ium-4-ylmethyl)-4H-1,3-benzodioxine-6-carboxylate

Systemtic Name: 8-(morpholin-4-ium-4-ylmethyl)-4H-1,3-benzodioxine-6-carboxylate Openeye Name: 8-(morpholin-4-ium-4-ylmethyl)-4H-1,3-benzodioxine-6-carboxylate CAS Name: 8-(4-morpholin-4-iumylmethyl)-4H-1,3-benzodioxin-6-carboxylate IUPAC Name: 8-(morpholin-4-ium-4-ylmethyl)-4H-1,3-benzodioxine-6-carboxylate Traditional Name: 8-(morpholin-4-ium-4-ylmethyl)-4H-1,3-benzodioxin-6-carboxylate Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC(=CC3=C2OCOC3)C(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC2=CC(=CC3=C2OCOC3)C(=O)[O-]

InChI

InChI=1S/C14H17NO5/c16-14(17)10-5-11(7-15-1-3-18-4-2-15)13-12(6-10)8-19-9-20-13/h5-6H,1-4,7-9H2,(H,16,17)