dimethyl 2-(10-oxidanylideneanthracen-9-ylidene)-1,3-benzodithiole-5,6-dicarboxylate

Systemtic Name: dimethyl 2-(10-oxidanylideneanthracen-9-ylidene)-1,3-benzodithiole-5,6-dicarboxylate Openeye Name: dimethyl 2-(10-oxo-9-anthrylidene)-1,3-benzodithiole-5,6-dicarboxylate CAS Name: 2-(10-oxo-9-anthracenylidene)-1,3-benzodithiole-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(10-oxoanthracen-9-ylidene)-1,3-benzodithiole-5,6-dicarboxylate Traditional Name: 2-(10-keto-9-anthrylidene)-1,3-benzodithiole-5,6-dicarboxylic acid dimethyl ester Formula: C25H16O5S2 MolecularWeight: 460.52154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1C(=O)OC)SC(=C3C4=CC=CC=C4C(=O)C5=CC=CC=C53)S2

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1C(=O)OC)SC(=C3C4=CC=CC=C4C(=O)C5=CC=CC=C53)S2

InChI

InChI=1S/C25H16O5S2/c1-29-23(27)17-11-19-20(12-18(17)24(28)30-2)32-25(31-19)21-13-7-3-5-9-15(13)22(26)16-10-6-4-8-14(16)21/h3-12H,1-2H3