ethyl (2E)-2-cyano-2-[4-(2-ethoxy-2-oxidanylidene-ethyl)-4-oxidanyl-1,3-dithiolan-2-ylidene]ethanoate

Systemtic Name: ethyl (2E)-2-cyano-2-[4-(2-ethoxy-2-oxidanylidene-ethyl)-4-oxidanyl-1,3-dithiolan-2-ylidene]ethanoate Openeye Name: ethyl (2E)-2-cyano-2-[4-(2-ethoxy-2-oxo-ethyl)-4-hydroxy-1,3-dithiolan-2-ylidene]acetate CAS Name: (2E)-2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-4-hydroxy-1,3-dithiolan-2-ylidene]acetic acid ethyl ester IUPAC Name: ethyl (2E)-2-cyano-2-[4-(2-ethoxy-2-oxoethyl)-4-hydroxy-1,3-dithiolan-2-ylidene]acetate Traditional Name: (2E)-2-cyano-2-[4-(2-ethoxy-2-keto-ethyl)-4-hydroxy-1,3-dithiolan-2-ylidene]acetic acid ethyl ester Formula: C12H15NO5S2 MolecularWeight: 317.3812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(CSC(=C(C#N)C(=O)OCC)S1)O

Isomeric SMILES

CCOC(=O)CC1(CS/C(=C(/C#N)\C(=O)OCC)/S1)O

InChI

InChI=1S/C12H15NO5S2/c1-3-17-9(14)5-12(16)7-19-11(20-12)8(6-13)10(15)18-4-2/h16H,3-5,7H2,1-2H3/b11-8+