octan-3-yl 7-oxidanylidene-4H-thieno[3,2-b]pyridine-6-carboxylate

Systemtic Name: octan-3-yl 7-oxidanylidene-4H-thieno[3,2-b]pyridine-6-carboxylate Openeye Name: 1-ethylhexyl 7-oxo-4H-thieno[3,2-b]pyridine-6-carboxylate CAS Name: 7-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid octan-3-yl ester IUPAC Name: octan-3-yl 7-oxo-4H-thieno[3,2-b]pyridine-6-carboxylate Traditional Name: 7-keto-4H-thieno[3,2-b]pyridine-6-carboxylic acid 1-ethylhexyl ester Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C1=CNC2=C(C1=O)SC=C2

Isomeric SMILES

CCCCCC(CC)OC(=O)C1=CNC2=C(C1=O)SC=C2

InChI

InChI=1S/C16H21NO3S/c1-3-5-6-7-11(4-2)20-16(19)12-10-17-13-8-9-21-15(13)14(12)18/h8-11H,3-7H2,1-2H3,(H,17,18)