6-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-5-carboxylic acid

Systemtic Name: 6-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-5-carboxylic acid Openeye Name: 6-(3,3-dimethyl-2-oxo-pentanoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-5-carboxylic acid CAS Name: 6-(3,3-dimethyl-1,2-dioxopentyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-5-carboxylic acid IUPAC Name: 6-(3,3-dimethyl-2-oxopentanoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-5-carboxylic acid Traditional Name: 6-(2-keto-3,3-dimethyl-pentanoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-5-carboxylic acid Formula: C15H19NO4S MolecularWeight: 309.38066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CC2=C(CC1C(=O)O)C=CS2

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CC2=C(CC1C(=O)O)C=CS2

InChI

InChI=1S/C15H19NO4S/c1-4-15(2,3)12(17)13(18)16-8-11-9(5-6-21-11)7-10(16)14(19)20/h5-6,10H,4,7-8H2,1-3H3,(H,19,20)