7-tert-butyl-4-oxidanylidene-thieno[2,3-b]pyridine-5-carboxylic acid

Systemtic Name: 7-tert-butyl-4-oxidanylidene-thieno[2,3-b]pyridine-5-carboxylic acid Openeye Name: 7-tert-butyl-4-oxo-thieno[2,3-b]pyridine-5-carboxylic acid CAS Name: 7-tert-butyl-4-oxo-5-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 7-tert-butyl-4-oxothieno[2,3-b]pyridine-5-carboxylic acid Traditional Name: 7-tert-butyl-4-keto-thieno[2,3-b]pyridine-5-carboxylic acid Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=O)C2=C1SC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)N1C=C(C(=O)C2=C1SC=C2)C(=O)O

InChI

InChI=1S/C12H13NO3S/c1-12(2,3)13-6-8(11(15)16)9(14)7-4-5-17-10(7)13/h4-6H,1-3H3,(H,15,16)