ethyl 2-[4-(1-cyano-2-ethylperoxy-ethylidene)-1,3-dithietan-2-ylidene]-2-isocyano-ethanoate

Systemtic Name: ethyl 2-[4-(1-cyano-2-ethylperoxy-ethylidene)-1,3-dithietan-2-ylidene]-2-isocyano-ethanoate Openeye Name: ethyl 2-[4-(1-cyano-2-ethylperoxy-ethylidene)-1,3-dithietan-2-ylidene]-2-isocyano-acetate CAS Name: 2-[4-(1-cyano-2-ethyldioxyethylidene)-1,3-dithietan-2-ylidene]-2-isocyanoacetic acid ethyl ester IUPAC Name: ethyl 2-[4-(1-cyano-2-ethylperoxyethylidene)-1,3-dithietan-2-ylidene]-2-isocyanoacetate Traditional Name: 2-[4-(1-cyano-2-ethylperoxy-ethylidene)-1,3-dithietan-2-ylidene]-2-isocyano-acetic acid ethyl ester Formula: C12H12N2O4S2 MolecularWeight: 312.36468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1SC(=C(COOCC)C#N)S1)[N+]#[C-]

Isomeric SMILES

CCOC(=O)C(=C1SC(=C(COOCC)C#N)S1)[N+]#[C-]

InChI

InChI=1S/C12H12N2O4S2/c1-4-16-10(15)9(14-3)12-19-11(20-12)8(6-13)7-18-17-5-2/h4-5,7H2,1-2H3