5-[bis(oxidanyl)methylidene]-7-butyl-thieno[2,3-b]pyridine-4,6-dione

Systemtic Name: 5-[bis(oxidanyl)methylidene]-7-butyl-thieno[2,3-b]pyridine-4,6-dione Openeye Name: 7-butyl-5-(dihydroxymethylene)thieno[2,3-b]pyridine-4,6-dione CAS Name: 7-butyl-5-(dihydroxymethylidene)thieno[2,3-b]pyridine-4,6-dione IUPAC Name: 7-butyl-5-(dihydroxymethylidene)thieno[2,3-b]pyridine-4,6-dione Traditional Name: 7-butyl-5-(dihydroxymethylene)thieno[2,3-b]pyridine-4,6-quinone Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CS2)C(=O)C(=C(O)O)C1=O

Isomeric SMILES

CCCCN1C2=C(C=CS2)C(=O)C(=C(O)O)C1=O

InChI

InChI=1S/C12H13NO4S/c1-2-3-5-13-10(15)8(12(16)17)9(14)7-4-6-18-11(7)13/h4,6,16-17H,2-3,5H2,1H3