7-butyl-5-nitro-6-oxidanyl-thieno[2,3-b]pyridin-4-one

Systemtic Name: 7-butyl-5-nitro-6-oxidanyl-thieno[2,3-b]pyridin-4-one Openeye Name: 7-butyl-6-hydroxy-5-nitro-thieno[2,3-b]pyridin-4-one CAS Name: 7-butyl-6-hydroxy-5-nitro-4-thieno[2,3-b]pyridinone IUPAC Name: 7-butyl-6-hydroxy-5-nitrothieno[2,3-b]pyridin-4-one Traditional Name: 7-butyl-6-hydroxy-5-nitro-thieno[2,3-b]pyridin-4-one Formula: C11H12N2O4S MolecularWeight: 268.28898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)C2=C1SC=C2)[N+](=O)[O-])O

Isomeric SMILES

CCCCN1C(=C(C(=O)C2=C1SC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C11H12N2O4S/c1-2-3-5-12-10(15)8(13(16)17)9(14)7-4-6-18-11(7)12/h4,6,15H,2-3,5H2,1H3