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

Systemtic Name: 7-tert-butyl-2-chloranyl-4-oxidanylidene-thieno[2,3-b]pyridine-5-carboxylic acid Openeye Name: 7-tert-butyl-2-chloro-4-oxo-thieno[2,3-b]pyridine-5-carboxylic acid CAS Name: 7-tert-butyl-2-chloro-4-oxo-5-thieno[2,3-b]pyridinecarboxylic acid IUPAC Name: 7-tert-butyl-2-chloro-4-oxothieno[2,3-b]pyridine-5-carboxylic acid Traditional Name: 7-tert-butyl-2-chloro-4-keto-thieno[2,3-b]pyridine-5-carboxylic acid Formula: C12H12ClNO3S MolecularWeight: 285.74658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClNO3S/c1-12(2,3)14-5-7(11(16)17)9(15)6-4-8(13)18-10(6)14/h4-5H,1-3H3,(H,16,17)