dimethyl 2-(1-chloranyl-2-phenoxy-2-sulfanylidene-ethylidene)-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-(1-chloranyl-2-phenoxy-2-sulfanylidene-ethylidene)-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-(1-chloro-2-phenoxy-2-thioxo-ethylidene)-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-(1-chloro-2-phenoxy-2-sulfanylideneethylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(1-chloro-2-phenoxy-2-sulfanylideneethylidene)-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-(1-chloro-2-phenoxy-2-thioxo-ethylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C15H11ClO5S3 MolecularWeight: 402.89284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C(C(=S)OC2=CC=CC=C2)Cl)S1)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SC(=C(C(=S)OC2=CC=CC=C2)Cl)S1)C(=O)OC

InChI

InChI=1S/C15H11ClO5S3/c1-19-12(17)10-11(13(18)20-2)24-15(23-10)9(16)14(22)21-8-6-4-3-5-7-8/h3-7H,1-2H3