dimethyl 2-(1,3-dithiol-2-ylidene)-3a,6-dihydro-1,3-benzodithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-(1,3-dithiol-2-ylidene)-3a,6-dihydro-1,3-benzodithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-(1,3-dithiol-2-ylidene)-3a,6-dihydro-1,3-benzodithiole-4,5-dicarboxylate CAS Name: 2-(1,3-dithiol-2-ylidene)-3a,6-dihydro-1,3-benzodithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(1,3-dithiol-2-ylidene)-3a,6-dihydro-1,3-benzodithiole-4,5-dicarboxylate Traditional Name: 2-(1,3-dithiol-2-ylidene)-3a,6-dihydro-1,3-benzodithiole-4,5-dicarboxylic acid dimethyl ester Formula: C14H12O4S4 MolecularWeight: 372.50268

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2C(=CC1)SC(=C3SC=CS3)S2)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C2C(=CC1)SC(=C3SC=CS3)S2)C(=O)OC

InChI

InChI=1S/C14H12O4S4/c1-17-11(15)7-3-4-8-10(9(7)12(16)18-2)22-14(21-8)13-19-5-6-20-13/h4-6,10H,3H2,1-2H3