(3E)-3-[methoxy(oxidanyl)methylidene]-2H-isoquinoline-7,8-dione hydrochloride

Systemtic Name: (3E)-3-[methoxy(oxidanyl)methylidene]-2H-isoquinoline-7,8-dione hydrochloride Openeye Name: (3E)-3-[hydroxy(methoxy)methylene]-2H-isoquinoline-7,8-dione hydrochloride CAS Name: (3E)-3-[hydroxy(methoxy)methylidene]-2H-isoquinoline-7,8-dione hydrochloride IUPAC Name: (3E)-3-[hydroxy(methoxy)methylidene]-2H-isoquinoline-7,8-dione hydrochloride Traditional Name: (3E)-3-[hydroxy(methoxy)methylene]-2H-isoquinoline-7,8-quinone hydrochloride Formula: C11H10ClNO4 MolecularWeight: 255.6544

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C1C=C2C=CC(=O)C(=O)C2=CN1)O.Cl

Isomeric SMILES

CO/C(=C/1\C=C2C=CC(=O)C(=O)C2=CN1)/O.Cl

InChI

InChI=1S/C11H9NO4.ClH/c1-16-11(15)8-4-6-2-3-9(13)10(14)7(6)5-12-8;/h2-5,12,15H,1H3;1H/b11-8+;