7-butoxy-5-(2,2-dimethylpropyl)-4-oxidanylidene-thieno[3,2-c]pyridine-6-carboxylic acid

Systemtic Name: 7-butoxy-5-(2,2-dimethylpropyl)-4-oxidanylidene-thieno[3,2-c]pyridine-6-carboxylic acid Openeye Name: 7-butoxy-5-(2,2-dimethylpropyl)-4-oxo-thieno[3,2-c]pyridine-6-carboxylic acid CAS Name: 7-butoxy-5-(2,2-dimethylpropyl)-4-oxo-6-thieno[3,2-c]pyridinecarboxylic acid IUPAC Name: 7-butoxy-5-(2,2-dimethylpropyl)-4-oxothieno[3,2-c]pyridine-6-carboxylic acid Traditional Name: 7-butoxy-4-keto-5-neopentyl-thieno[3,2-c]pyridine-6-carboxylic acid Formula: C17H23NO4S MolecularWeight: 337.43382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=C1SC=C2)CC(C)(C)C)C(=O)O

Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=C1SC=C2)CC(C)(C)C)C(=O)O

InChI

InChI=1S/C17H23NO4S/c1-5-6-8-22-13-12(16(20)21)18(10-17(2,3)4)15(19)11-7-9-23-14(11)13/h7,9H,5-6,8,10H2,1-4H3,(H,20,21)