6,7-dimethoxy-2-methyl-1-oxidanyl-isoquinolin-2-ium-3,4-dione

Systemtic Name: 6,7-dimethoxy-2-methyl-1-oxidanyl-isoquinolin-2-ium-3,4-dione Openeye Name: 1-hydroxy-6,7-dimethoxy-2-methyl-isoquinolin-2-ium-3,4-dione CAS Name: 1-hydroxy-6,7-dimethoxy-2-methylisoquinolin-2-ium-3,4-dione IUPAC Name: 1-hydroxy-6,7-dimethoxy-2-methylisoquinolin-2-ium-3,4-dione Traditional Name: 1-hydroxy-6,7-dimethoxy-2-methyl-isoquinolin-2-ium-3,4-quinone Formula: C12H12NO5+ MolecularWeight: 250.22738

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=CC(=C(C=C2C(=O)C1=O)OC)OC)O

Isomeric SMILES

C[N+]1=C(C2=CC(=C(C=C2C(=O)C1=O)OC)OC)O

InChI

InChI=1S/C12H11NO5/c1-13-11(15)7-5-9(18-3)8(17-2)4-6(7)10(14)12(13)16/h4-5H,1-3H3/p+1