ethyl 4-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1,2,3,6-tetrahydropyridine-5-carboxylate

Systemtic Name: ethyl 4-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1,2,3,6-tetrahydropyridine-5-carboxylate Openeye Name: ethyl 4-(2-ethoxy-2-oxo-ethyl)sulfanyl-1,2,3,6-tetrahydropyridine-5-carboxylate CAS Name: 4-[(2-ethoxy-2-oxoethyl)thio]-1,2,3,6-tetrahydropyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-ethoxy-2-oxoethyl)sulfanyl-1,2,3,6-tetrahydropyridine-5-carboxylate Traditional Name: 4-[(2-ethoxy-2-keto-ethyl)thio]-1,2,3,6-tetrahydropyridine-5-carboxylic acid ethyl ester Formula: C12H19NO4S MolecularWeight: 273.34856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(CNCC1)C(=O)OCC

Isomeric SMILES

CCOC(=O)CSC1=C(CNCC1)C(=O)OCC

InChI

InChI=1S/C12H19NO4S/c1-3-16-11(14)8-18-10-5-6-13-7-9(10)12(15)17-4-2/h13H,3-8H2,1-2H3