dimethyl (4R,5R)-2-phenacylidene-1,3-dithiolane-4,5-dicarboxylate

Systemtic Name: dimethyl (4R,5R)-2-phenacylidene-1,3-dithiolane-4,5-dicarboxylate Openeye Name: dimethyl (4R,5R)-2-phenacylidene-1,3-dithiolane-4,5-dicarboxylate CAS Name: (4R,5R)-2-phenacylidene-1,3-dithiolane-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4R,5R)-2-phenacylidene-1,3-dithiolane-4,5-dicarboxylate Traditional Name: (4R,5R)-2-phenacylidene-1,3-dithiolane-4,5-dicarboxylic acid dimethyl ester Formula: C15H14O5S2 MolecularWeight: 338.39866

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(SC(=CC(=O)C2=CC=CC=C2)S1)C(=O)OC

Isomeric SMILES

COC(=O)[C@@H]1[C@H](SC(=CC(=O)C2=CC=CC=C2)S1)C(=O)OC

InChI

InChI=1S/C15H14O5S2/c1-19-14(17)12-13(15(18)20-2)22-11(21-12)8-10(16)9-6-4-3-5-7-9/h3-8,12-13H,1-2H3/t12-,13-/m0/s1