2-(4,7-dimethoxyquinolin-1-ium-2-yl)ethanoate

Systemtic Name: 2-(4,7-dimethoxyquinolin-1-ium-2-yl)ethanoate Openeye Name: 2-(4,7-dimethoxyquinolin-1-ium-2-yl)acetate CAS Name: 2-(4,7-dimethoxy-2-quinolin-1-iumyl)acetate IUPAC Name: 2-(4,7-dimethoxyquinolin-1-ium-2-yl)acetate Traditional Name: 2-(4,7-dimethoxyquinolin-1-ium-2-yl)acetate Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=[NH+]2)CC(=O)[O-])OC

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=[NH+]2)CC(=O)[O-])OC

InChI

InChI=1S/C13H13NO4/c1-17-9-3-4-10-11(7-9)14-8(6-13(15)16)5-12(10)18-2/h3-5,7H,6H2,1-2H3,(H,15,16)