(E)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)-1-methoxy-ethenolate

Systemtic Name: (E)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)-1-methoxy-ethenolate Openeye Name: (E)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)-1-methoxy-ethenolate CAS Name: (E)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)-1-methoxyethenolate IUPAC Name: (E)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)-1-methoxyethenolate Traditional Name: (E)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium-2-yl)-1-methoxy-ethenolate Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=[N+](CCC2=C1)C=C([O-])OC)OC

Isomeric SMILES

COC1=C(C=C2C=[N+](CCC2=C1)/C=C(\[O-])/OC)OC

InChI

InChI=1S/C14H17NO4/c1-17-12-6-10-4-5-15(9-14(16)19-3)8-11(10)7-13(12)18-2/h6-9H,4-5H2,1-3H3/b14-9+