dimethyl 2-(3-oxidanylidene-1H-inden-2-ylidene)-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-(3-oxidanylidene-1H-inden-2-ylidene)-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-(1-oxoindan-2-ylidene)-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-(3-oxo-1H-inden-2-ylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(3-oxo-1H-inden-2-ylidene)-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-(1-ketoindan-2-ylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C16H12O5S2 MolecularWeight: 348.39348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C2CC3=CC=CC=C3C2=O)S1)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SC(=C2CC3=CC=CC=C3C2=O)S1)C(=O)OC

InChI

InChI=1S/C16H12O5S2/c1-20-14(18)12-13(15(19)21-2)23-16(22-12)10-7-8-5-3-4-6-9(8)11(10)17/h3-6H,7H2,1-2H3