dimethyl 2-(3,3-dicyanoprop-2-enylidene)-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-(3,3-dicyanoprop-2-enylidene)-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-(3,3-dicyanoprop-2-enylidene)-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-(3,3-dicyanoprop-2-enylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(3,3-dicyanoprop-2-enylidene)-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-(3,3-dicyanoprop-2-enylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C12H8N2O4S2 MolecularWeight: 308.33292

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=CC=C(C#N)C#N)S1)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SC(=CC=C(C#N)C#N)S1)C(=O)OC

InChI

InChI=1S/C12H8N2O4S2/c1-17-11(15)9-10(12(16)18-2)20-8(19-9)4-3-7(5-13)6-14/h3-4H,1-2H3