3-[bis(oxidanyl)methylidene]-7-methyl-isoquinoline-1,4-dione

Systemtic Name: 3-[bis(oxidanyl)methylidene]-7-methyl-isoquinoline-1,4-dione Openeye Name: 3-(dihydroxymethylene)-7-methyl-isoquinoline-1,4-dione CAS Name: 3-(dihydroxymethylidene)-7-methylisoquinoline-1,4-dione IUPAC Name: 3-(dihydroxymethylidene)-7-methylisoquinoline-1,4-dione Traditional Name: 3-(dihydroxymethylene)-7-methyl-isoquinoline-1,4-quinone Formula: C11H9NO4 MolecularWeight: 219.19346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C(=C(O)O)NC2=O

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C(=C(O)O)NC2=O

InChI

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