6,7-dimethoxy-3-(4-methoxyphenyl)-2-oxidanidyl-isoquinolin-2-ium

Systemtic Name: 6,7-dimethoxy-3-(4-methoxyphenyl)-2-oxidanidyl-isoquinolin-2-ium Openeye Name: 6,7-dimethoxy-3-(4-methoxyphenyl)-2-oxido-isoquinolin-2-ium CAS Name: 6,7-dimethoxy-3-(4-methoxyphenyl)-2-oxidoisoquinolin-2-ium IUPAC Name: 6,7-dimethoxy-3-(4-methoxyphenyl)-2-oxidoisoquinolin-2-ium Traditional Name: 6,7-dimethoxy-3-(4-methoxyphenyl)-2-oxido-isoquinolin-2-ium Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC3=CC(=C(C=C3C=[N+]2[O-])OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC3=CC(=C(C=C3C=[N+]2[O-])OC)OC

InChI

InChI=1S/C18H17NO4/c1-21-15-6-4-12(5-7-15)16-8-13-9-17(22-2)18(23-3)10-14(13)11-19(16)20/h4-11H,1-3H3