tert-butyl 4-(2-thiophen-2-ylethynyl)-1,2,3,6-tetrahydropyridine-2-carboxylate

Systemtic Name: tert-butyl 4-(2-thiophen-2-ylethynyl)-1,2,3,6-tetrahydropyridine-2-carboxylate Openeye Name: tert-butyl 4-[2-(2-thienyl)ethynyl]-1,2,3,6-tetrahydropyridine-2-carboxylate CAS Name: 4-(2-thiophen-2-ylethynyl)-1,2,3,6-tetrahydropyridine-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-thiophen-2-ylethynyl)-1,2,3,6-tetrahydropyridine-2-carboxylate Traditional Name: 4-[2-(2-thienyl)ethynyl]-1,2,3,6-tetrahydropyridine-2-carboxylic acid tert-butyl ester Formula: C16H19NO2S MolecularWeight: 289.39256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CC(=CCN1)C#CC2=CC=CS2

Isomeric SMILES

CC(C)(C)OC(=O)C1CC(=CCN1)C#CC2=CC=CS2

InChI

InChI=1S/C16H19NO2S/c1-16(2,3)19-15(18)14-11-12(8-9-17-14)6-7-13-5-4-10-20-13/h4-5,8,10,14,17H,9,11H2,1-3H3